SCHEMBL6274814

SCHEMBL6274814

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

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 9/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ AKR1B10 O60218 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ PTGES O14684 2/20 0.34
▸ FNTA P49354 2/20 0.34
▸ FNTB P49356 2/20 0.34
▸ PTGS1 P23219 3/20 0.34
▸ MAOB P27338 2/20 0.34
▸ PPARG P37231 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ POLL Q9UGP5 1/20 0.33
▸ CTSK P43235 1/20 0.33
▸ PTGS2 P35354 1/20 0.33

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
SCHEMBL6269718 1.00 ALOX5 (0.44) ALOX5KDM4EMEN1AKR1B10KMT2A
SCHEMBL6275233 0.90 ALOX5 (0.53) ALOX5KDM4EMEN1AKR1B10KMT2A
SCHEMBL6275024 0.83 ALOX5 (0.38) ALOX5FNTAFNTBPTGS1PPARG
SCHEMBL6275022 0.83 ALOX5 (0.38) ALOX5FNTAFNTBPTGS1PPARG
SCHEMBL6273624 0.82 TRPV1 (0.42) MEN1KMT2APOLL
SCHEMBL6273404 0.82 TRPV1 (0.42) MEN1KMT2APOLL
SCHEMBL6271863 0.78 ALOX5 (0.61) ALOX5KDM4EMEN1AKR1B10KMT2A
SCHEMBL6271590 0.78 ALOX5 (0.61) ALOX5KDM4EMEN1AKR1B10KMT2A
SCHEMBL6269360 0.78 ALOX5 (0.42) ALOX5KDM4EMEN1AKR1B10KMT2A
SCHEMBL21122607 0.75 ALOX5 (0.45) ALOX5KDM4EMEN1AKR1B10KMT2A

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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