SCHEMBL3970906

SCHEMBL3970906

COc1ccc(C(=O)/C=C/c2cc(C)c(C(=O)O)c(C)c2OC(C)C)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KRAS P01116 1/20 0.51
TNFRSF1A P19438 3/20 0.49
GABRA3 P34903 1/20 0.49
GABRA2 P47869 1/20 0.49
GABRB2 P47870 1/20 0.49
XDH P47989 1/20 0.48
ABCG2 Q9UNQ0 1/20 0.47
MAOB P27338 5/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPT P10636 2/20 0.46
MEN1 O00255 1/20 0.46
HSPD1 P10809 1/20 0.46
HSPE1 P61604 1/20 0.46
KMT2A Q03164 1/20 0.46
CYP1B1 Q16678 1/20 0.46
F3 P13726 1/20 0.46
MAOA P21397 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL3969812 0.89 CAPN1 (0.45) MAOBMAPTMAOANPC1RAB9A
SCHEMBL1778808 0.88 CA1 (0.48) KRASTNFRSF1AABCG2MAOBALDH1A1
SCHEMBL3964836 0.88 ALDH1A1 (0.48) KRASTNFRSF1AABCG2MAOBALDH1A1
SCHEMBL498833 0.88 MAPT (0.44) MAOBALDH1A1MAPTCYP1B1MAOA
SCHEMBL3972097 0.88 LMNA (0.46) KRASABCG2MAPTRAB9ASMN1; SMN2
SCHEMBL3969980 0.88 CXCL12 (0.41) KRASABCG2ALDH1A1SMN1; SMN2CXCL12
SCHEMBL499277 0.88 CA1 (0.48) KRASTNFRSF1AABCG2MAOBALDH1A1
SCHEMBL1933383 0.88 CYP1A1 (0.39) KRASTNFRSF1AGABRA3GABRA2GABRB2
SCHEMBL29382056 0.88 CYP1A1 (0.39) KRASTNFRSF1AGABRA3GABRA2GABRB2
SCHEMBL3968303 0.87 ABCG2 (0.47) ABCG2MAOBALDH1A1MAPTCYP1B1

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9221751-B2 Use of 1,3-diphenylprop-2-en-1-one derivatives for treating liver disorders GENFIT (FR) 2015-12-29 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
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-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-20170368007-A1 USE OF 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES FOR TREATING LIVER DISORDERS GENFIT (FR) 2017-12-28 US disclosed
US-9782373-B2 Use of 1,3-diphenylprop-2-en-1-one derivatives for treating liver disorders GENFIT (FR) 2017-10-10 US disclosed
US-20170128399-A1 USE OF 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES FOR TREATING LIVER DISORDERS GENFIT (FR) 2017-05-11 US disclosed
US-9585853-B2 Use of 1,3-diphenylprop-2-en-1-one derivatives for treating liver disorders GENFIT (FR) 2017-03-07 US disclosed
US-20160051501-A1 USE OF 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES FOR TREATING LIVER DISORDERS GENFIT (FR) 2016-02-25 US disclosed
US-9221751-B2 Use of 1,3-diphenylprop-2-en-1-one derivatives for treating liver disorders GENFIT (FR) 2015-12-29 US disclosed
US-20150051145-A1 USE OF 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES FOR TREATING LIVER DISORDERS GENFIT (FR) 2015-02-19 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-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

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

For each of this compound's patents that has machine-readable text (9 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-20170368007-A1 USE OF 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES FOR TREATING LIVER DISORDERS FABP1, GOT2, GOT1 KRAS 4681/4885TNFRSF1A 3393/4885GABRA3 4375/4885
US-20170128399-A1 USE OF 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES FOR TREATING LIVER DISORDERS FABP1, GOT2, GOT1 KRAS 4681/4885TNFRSF1A 3393/4885GABRA3 4375/4885
US-20070032543-A1 Combinations of substituted 1,3-diphenylprop-2-EN-1-one derivatives with other therapeutically active ingredients PSEN1, BACE1, PSEN2 KRAS 2652/4885TNFRSF1A 2548/4885GABRA3 4275/4885
US-20160051501-A1 USE OF 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES FOR TREATING LIVER DISORDERS FABP1, GOT2, GOT1 KRAS 4681/4885TNFRSF1A 3393/4885GABRA3 4375/4885
US-20150051145-A1 USE OF 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES FOR TREATING LIVER DISORDERS FABP1, GOT2, GOT1 KRAS 4681/4885TNFRSF1A 3393/4885GABRA3 4375/4885
US-20180280328-A1 USE OF 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES FOR TREATING LIVER DISORDERS FABP1, GOT2, GOT1 KRAS 4681/4885TNFRSF1A 3393/4885GABRA3 4375/4885
US-20200384105-A1 USE OF 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES FOR TREATING LIVER DISORDERS FABP1, GOT2, GOT1 KRAS 4681/4885TNFRSF1A 3393/4885GABRA3 4375/4885
US-10350181-B2 Use of 1,3-diphenylprop-2-en-1-one derivatives for treating liver disorders FABP1, GOT2, GOT1 KRAS 4681/4885TNFRSF1A 3393/4885GABRA3 4375/4885
US-10022343-B2 Use of 1,3-diphenylprop-2-en-1-one derivatives for treating liver disorders FABP1, GOT2, GOT1 KRAS 4681/4885TNFRSF1A 3393/4885GABRA3 4375/4885

“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.