SCHEMBL498631

SCHEMBL498631

Cc1cc(/C=C/C(=O)c2ccc(Br)cc2)c(OC(C)C)c(C)c1C(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
KRAS P01116 1/20 0.42
ALOX5 P09917 1/20 0.40
AR P10275 1/20 0.39
DPP4 P27487 1/20 0.39
CXCL12 P48061 1/20 0.38
MAOA P21397 2/20 0.37
PTPN1 P18031 2/20 0.37
MAOB P27338 2/20 0.37
TNFRSF1A P19438 1/20 0.36
MAPT P10636 2/20 0.35
MEN1 O00255 1/20 0.35
MITF O75030 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
PAX8 Q06710 1/20 0.35
ATM Q13315 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL499469 0.90 MAPT (0.40) CXCL12MAOAMAOBMAPTLMNA
SCHEMBL29379677 0.88 PPARG (0.46) MAOBMAPTMEN1ALDH1A1LMNA
SCHEMBL29381917 0.88 CYP1A1 (0.49) DPP4CXCL12MAOBCYP1B1CYP1A1
SCHEMBL498873 0.88 PPARG (0.46) MAOBMAPTMEN1ALDH1A1LMNA
SCHEMBL15361865 0.88 CYP1A1 (0.49) DPP4CXCL12MAOBCYP1B1CYP1A1
SCHEMBL15361844 0.87 CYP1A1 (0.37) KRASMAOBTNFRSF1AMAPTMEN1
SCHEMBL29214716 0.87 CYP1A1 (0.37) KRASMAOBTNFRSF1AMAPTMEN1
SCHEMBL499277 0.86 CA1 (0.48) CA1CA2KRASALOX5AR
SCHEMBL1778808 0.86 CA1 (0.48) CA1CA2KRASALOX5AR
SCHEMBL499495 0.84 THRA (0.43) MEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461212-B2 Composition based on substituted 1,3-diphenylprop-2-en-1-one derivatives, preparation and uses thereof GENFIT (FR) 2013-06-11 US claimed
US-20120129932-A1 COMPOSITION BASED ON SUBSTITUTED 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES, PREPARATION AND USES THEREOF GENFIT (FR) 2012-05-24 US claimed
US-7943661-B2 Antiischemic agents; for example 1-[2-hydroxy-4-chlorophenyl]-3-[4-carboxydimethylmethyloxyphenyl]prop-2-en-1-one; display peroxisome proliferator activated receptor (PPAR) activator, antioxidant and antiinflammatory properties GENFIT (FR) 2011-05-17 US claimed
US-7632870-B2 Composition based on substituted 1,3-diphenylprop-2-en-1-one derivatives, preparation and uses thereof GENFIT (FR) 2009-12-15 US claimed
US-7566737-B2 Combinations of substituted 1,3-diphenylprop-2-en-1-one derivatives with other therapeutically active ingredients GENFIT (FR) 2009-07-28 US claimed
EP-1525177-B1 SUBSTITUTED 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES, PREPARATION AND USES THEREOF GENFIT (FR) 2007-06-27 EP claimed
EP-1519908-B1 COMPOSITION BASED ON SUBSTITUTED 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES, PREPARATION AND USES THEREOF GENFIT (FR) 2007-06-13 EP claimed
US-20070032543-A1 Combinations of substituted 1,3-diphenylprop-2-EN-1-one derivatives with other therapeutically active ingredients GENFIT (FR) 2007-02-08 US claimed
US-20200384105-A1 USE OF 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES FOR TREATING LIVER DISORDERS GENFIT (FR) 2020-12-10 US disclosed
US-10722575-B2 Use of 1,3-diphenylprop-2-en-1-one derivatives for treating liver disorders GENFIT (FR) 2020-07-28 US disclosed
US-20190275146-A1 USE OF 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES FOR TREATING LIVER DISORDERS GENFIT (FR) 2019-09-12 US disclosed
US-10350181-B2 Use of 1,3-diphenylprop-2-en-1-one derivatives for treating liver disorders GENFIT (FR) 2019-07-16 US disclosed
US-20180280328-A1 USE OF 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES FOR TREATING LIVER DISORDERS GENFIT (FR) 2018-10-04 US disclosed
US-10022343-B2 Use of 1,3-diphenylprop-2-en-1-one derivatives for treating liver disorders GENFIT (FR) 2018-07-17 US disclosed
US-7566737-B2 Combinations of substituted 1,3-diphenylprop-2-en-1-one derivatives with other therapeutically active ingredients GENFIT (FR) 2009-07-28 US disclosed
US-7385082-B2 Preparation of 1,3-diphenylprop-2-en-1-one derivatives GENFIT (FR) 2008-06-10 US disclosed
US-20070032543-A1 Combinations of substituted 1,3-diphenylprop-2-EN-1-one derivatives with other therapeutically active ingredients GENFIT (FR) 2007-02-08 US disclosed
US-20060142611-A1 Preparation of 1,3-diphenylprop-2-en-1-one derivatives GENFIT (FR) 2006-06-29 US disclosed
US-20050176808-A1 Substituted 1,3-diphenylprop-2-en-1-one derivatives and preparation and uses thereof GENFIT (FR) 2005-08-11 US disclosed
US-20050171149-A1 Composition based on substituted 1,3-diphenylprop-2-en-1-one derivatives, preparation and uses thereof GENFIT (FR) 2005-08-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070032543-A1 Combinations of substituted 1,3-diphenylprop-2-EN-1-one derivatives with other therapeutically active ingredients PSEN1, BACE1, PSEN2 CA1 4658/4885CA2 4330/4885KRAS 2652/4885
US-20190275146-A1 USE OF 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES FOR TREATING LIVER DISORDERS FABP1, GOT2, GOT1 CA1 4667/4885CA2 4463/4885KRAS 4681/4885
US-20180280328-A1 USE OF 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES FOR TREATING LIVER DISORDERS FABP1, GOT2, GOT1 CA1 4667/4885CA2 4463/4885KRAS 4681/4885
US-20200384105-A1 USE OF 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES FOR TREATING LIVER DISORDERS FABP1, GOT2, GOT1 CA1 4667/4885CA2 4463/4885KRAS 4681/4885
US-10722575-B2 Use of 1,3-diphenylprop-2-en-1-one derivatives for treating liver disorders FABP1, GOT2, GOT1 CA1 4667/4885CA2 4463/4885KRAS 4681/4885
US-20120129932-A1 COMPOSITION BASED ON SUBSTITUTED 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES, PREPARATION AND USES THEREOF BRCA1, COL1A1, APOL1 CA1 4875/4885CA2 4805/4885KRAS 3453/4885
US-10350181-B2 Use of 1,3-diphenylprop-2-en-1-one derivatives for treating liver disorders FABP1, GOT2, GOT1 CA1 4667/4885CA2 4463/4885KRAS 4681/4885
US-20050176808-A1 Substituted 1,3-diphenylprop-2-en-1-one derivatives and preparation and uses thereof PGF, PTGS1, PTGES3 CA1 1455/4885CA2 2944/4885KRAS 4705/4885
US-20050171149-A1 Composition based on substituted 1,3-diphenylprop-2-en-1-one derivatives, preparation and uses thereof BRCA1, LOXL1, APOL1 CA1 4880/4885CA2 4785/4885KRAS 3309/4885
US-20060142611-A1 Preparation of 1,3-diphenylprop-2-en-1-one derivatives DPEP1, PKD1, ENPP1 CA1 4509/4885CA2 4194/4885KRAS 1280/4885
US-10022343-B2 Use of 1,3-diphenylprop-2-en-1-one derivatives for treating liver disorders FABP1, GOT2, GOT1 CA1 4667/4885CA2 4463/4885KRAS 4681/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.