SCHEMBL2969633

SCHEMBL2969633

CCOC(=O)CCc1cc(C=O)ccc1OCC(C)C

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FOS P01100 2/20 0.47
JUN P05412 2/20 0.47
AKR1C3 P42330 1/20 0.45
ALDH1A1 P00352 8/20 0.44
HIF1A Q16665 1/20 0.44
CYP4F2 P78329 2/20 0.43
CYP4A11 Q02928 2/20 0.43
KDM4E B2RXH2 2/20 0.41
HPGD P15428 2/20 0.41
TSHR P16473 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
GPR55 Q9Y2T6 1/20 0.38

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
SCHEMBL2958785 0.83 FOS (0.58) FOSJUNAKR1C3ALDH1A1HIF1A
SCHEMBL4276983 0.81 FOS (0.61) FOSJUNAKR1C3ALDH1A1HIF1A
SCHEMBL2956872 0.81 CYP4F2 (0.58) AKR1C3ALDH1A1CYP4F2CYP4A11
SCHEMBL4281305 0.80 ALDH1A1 (0.59) AKR1C3ALDH1A1KDM4EHPGDTSHR
SCHEMBL4280879 0.79 FOS (0.62) FOSJUNALDH1A1HIF1ACYP4F2
SCHEMBL4276443 0.79 FOS (0.62) FOSJUNALDH1A1HIF1ACYP4F2
SCHEMBL26307358 0.79 CYP4F2 (0.55) ALDH1A1CYP4F2CYP4A11MAPT
SCHEMBL4276973 0.79 ALDH1A1 (0.44) FOSJUNAKR1C3ALDH1A1HIF1A
SCHEMBL4277644 0.78 FOS (0.64) FOSJUNAKR1C3ALDH1A1HIF1A
SCHEMBL4281117 0.77 FOS (0.46) FOSJUNAKR1C3ALDH1A1HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1445249-B1 NOVEL BENSOPHENONE DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO LTD (JP) 2012-11-07 EP disclosed
US-7772285-B2 Benzophenone derivatives or salts thereof TOYAMA CHEMICAL CO., LTD. (JP) 2010-08-10 US disclosed
US-20090118169-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL USE THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2009-05-07 US disclosed
US-7314888-B1 Compounds and medicinal use thereof TOYAMA CHEMICAL CO., LTD. (JP) 2008-01-01 US disclosed
US-20050113400-A1 Inhibitors of transcription factor AP-1; autoimmune diseases; rheumatoid arthritis; high safety and excellent pharmacokinetics in vivo SHUNICHI SHIOZAWA (JP) 2005-05-26 US disclosed
EP-1445249-A1 NOVEL BENSOPHENONE DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2004-08-11 EP disclosed
EP-1127869-A1 NOVEL COMPOUNDS AND MEDICINAL USE THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2001-08-29 EP 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 (2 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-20090118169-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL USE THEREOF SP1, AP1G1, AP1M1 FOS 63/4885JUN 20/4885AKR1C3 1841/4885
US-20050113400-A1 Inhibitors of transcription factor AP-1; autoimmune diseases; rheumatoid arthritis; high safety and excellent pharmacokinetics in vivo SP1, AP1G1, JUN FOS 163/4885JUN 3/4885AKR1C3 825/4885

“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.