SCHEMBL6273624

SCHEMBL6273624

CC(C)=CCC/C(C)=C/CC1(C/C=C(\C)CCC=C(C)C)C(=O)C(C(=O)Cc2ccccc2)=C(O)C=C1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 5/20 0.42
▸ LMNA P02545 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ ICMT O60725 1/20 0.39
▸ GMNN O75496 1/20 0.39
▸ TRPA1 O75762 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ CNR2 P34972 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ HPGD P15428 1/20 0.37

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
SCHEMBL6273404 1.00 TRPV1 (0.42) TRPV1LMNAMAPTICMTGMNN
SCHEMBL6271223 0.90 LMNA (0.42) LMNAMAPTCYP3A4MEN1HPGD
SCHEMBL6274814 0.82 ALOX5 (0.44) MEN1KMT2APOLL
SCHEMBL6269718 0.82 ALOX5 (0.44) MEN1KMT2APOLL
SCHEMBL6269604 0.81 TRPV1 (0.42) TRPV1LMNAMAPTCNR2MEN1
SCHEMBL6269601 0.81 TRPV1 (0.42) TRPV1LMNAMAPTCNR2MEN1
SCHEMBL6275024 0.77 ALOX5 (0.38) POLL
SCHEMBL6275022 0.77 ALOX5 (0.38) POLL
SCHEMBL6275233 0.70 ALOX5 (0.53) CYP3A4HIF1AMEN1KMT2A
SCHEMBL10036484 0.69 TRPV1 (0.57) TRPV1LMNAMAPTICMTGMNN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0994093-B1 POLYHYDROXYPHENOL DERIVATIVES AND PREVENTIVE AND THERAPEUTIC AGENTS FOR BONE AND CARTILAGE DISEASES CONTAINING THE SAME HOECHST MARION ROUSSEL LTD (JP) 2005-12-28 — — EP claimed
US-6177474-B1 AROMATIC COMPOUND CONTAINING KETONE AND HYDROXY GROUPS HOECHST MARION ROUSSEL (FR) 2001-01-23 — — US claimed
EP-0994093-A1 POLYHYDROXYPHENOL DERIVATIVES AND PREVENTIVE AND THERAPEUTIC AGENTS FOR BONE AND CARTILAGE DISEASES CONTAINING THE SAME Hoechst Marion Roussel, Ltd. (JP) 2000-04-19 — — EP claimed
EP-0994093-B1 POLYHYDROXYPHENOL DERIVATIVES AND PREVENTIVE AND THERAPEUTIC AGENTS FOR BONE AND CARTILAGE DISEASES CONTAINING THE SAME HOECHST MARION ROUSSEL LTD (JP) 2005-12-28 — — EP disclosed
US-6177474-B1 AROMATIC COMPOUND CONTAINING KETONE AND HYDROXY GROUPS HOECHST MARION ROUSSEL (FR) 2001-01-23 — — US disclosed
EP-0994093-A1 POLYHYDROXYPHENOL DERIVATIVES AND PREVENTIVE AND THERAPEUTIC AGENTS FOR BONE AND CARTILAGE DISEASES CONTAINING THE SAME Hoechst Marion Roussel, Ltd. (JP) 2000-04-19 — — EP disclosed
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