SCHEMBL9643258

SCHEMBL9643258

COc1c(OC)c(OC(C)c2ccc(C)cc2)c2ccc(Cl)cc2c1OC(=O)Cc1ccccc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 1/20 0.46
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35
APH1B Q8WW43 1/20 0.35
NCSTN Q92542 1/20 0.35
APH1A Q96BI3 1/20 0.35
PSENEN Q9NZ42 1/20 0.35
L3MBTL1 Q9Y468 4/20 0.34
LPAR1 Q92633 1/20 0.33
ANO1 Q5XXA6 1/20 0.33
ANO2 Q9NQ90 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PTGS2 P35354 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL9641690 0.88 ABCB11 (0.58) ABCB11PPARGPPARAL3MBTL1ANO1
SCHEMBL9643531 0.83 ABCB11 (0.52) ABCB11PPARGPPARAL3MBTL1ANO1
SCHEMBL9644109 0.83 ABCB11 (0.52) ABCB11PPARGPPARAL3MBTL1ANO1
SCHEMBL9643263 0.82 ABCB11 (0.45) ABCB11L3MBTL1ANO1ANO2SMN1; SMN2
SCHEMBL9643186 0.82 ABCB11 (0.50) ABCB11PPARGPPARAL3MBTL1ANO1
SCHEMBL9642515 0.82 ABCB11 (0.50) ABCB11PPARGPPARAL3MBTL1ANO1
SCHEMBL9641822 0.80 ABCB11 (0.46) ABCB11L3MBTL1ANO1ANO2MAPT
SCHEMBL9643246 0.79 ABCB11 (0.50) ABCB11PSEN1PSEN2APH1BNCSTN
SCHEMBL9643164 0.73 ABCB11 (0.62) ABCB11L3MBTL1MAPTSMN1; SMN2TDP1
SCHEMBL9643005 0.71 ABCB11 (0.44) ABCB11MAPTSMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0215622-B1 NAPHTHALENE ANTI-PSORIATIC AGENTS AND PROCESS FOR MAKING THEM SYNTEX (U.S.A.) INC. (US) 1992-06-17 EP disclosed
US-4946845-A STABLE ANTIINFLAMMATORY AGENTS, LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1990-08-07 US disclosed
US-4792556-A LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1988-12-20 US disclosed