SCHEMBL7796258

SCHEMBL7796258

COc1cccc(-c2c(OC)cccc2C(=O)O)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 1/20 0.55
FABP3 P05413 1/20 0.55
FABP4 P15090 1/20 0.55
FABP5 Q01469 1/20 0.55
KDM4E B2RXH2 3/20 0.52
POLB P06746 1/20 0.52
DHODH Q02127 1/20 0.51
VDR P11473 1/20 0.50
HCAR2 Q8TDS4 1/20 0.49
KMT2A Q03164 2/20 0.49
LMNA P02545 1/20 0.49
AKR1C3 P42330 2/20 0.49
AKR1C2 P52895 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 2/20 0.49
GAA P10253 1/20 0.49
HTT P42858 2/20 0.48
MEN1 O00255 1/20 0.48
PKM P14618 1/20 0.48
MAPK1 P28482 1/20 0.48

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
SCHEMBL15782121 0.87 KDM4E (0.53) GPR35FABP3FABP4FABP5KDM4E
SCHEMBL7431016 0.87 ERN1 (0.47) GPR35FABP3FABP4FABP5KDM4E
SCHEMBL5845535 0.85 FABP4 (0.70) FABP3FABP4FABP5KDM4EDHODH
SCHEMBL6206680 0.85 GPR35 (0.55) GPR35KDM4EPOLBDHODHLMNA
SCHEMBL28818161 0.85 FABP3 (0.55) FABP3FABP4FABP5KDM4EPOLB
SCHEMBL4983522 0.84 FABP3 (0.57) GPR35FABP3FABP4FABP5KDM4E
SCHEMBL27501023 0.80 GPR35 (0.56) GPR35KDM4EPOLBDHODHKMT2A
SCHEMBL4603073 0.80 KDM4E (0.61) GPR35KDM4EPOLBDHODHHCAR2
SCHEMBL5085746 0.79 HNF4A (0.63) GPR35KDM4EPOLBDHODHLMNA
SCHEMBL10471506 0.78 GPR35 (0.55) GPR35KDM4EPOLBDHODHLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0906268-B1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS AVENTIS PHARMA INC (US) 2001-11-28 EP disclosed
US-6004959-A HYPOTENSIVE, ANTITUMOR, ANTIINFLAMMATORY AND ANTIASTHMATIC AGENTS; ANGIOGENESIS AND ALVEOLAR MACROPHAGE ACTIVATION INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-12-21 US disclosed
EP-0906268-A1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-04-07 EP disclosed
WO-1997045397-A1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1997-12-04 WO disclosed