SCHEMBL9643263

SCHEMBL9643263

COc1c(OC)c(OC(=O)Cc2ccccc2C)c2cc(Cl)ccc2c1OCCc1ccc(C)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 1/20 0.45
PDE4D Q08499 2/20 0.35
ANO1 Q5XXA6 1/20 0.35
ANO2 Q9NQ90 1/20 0.35
SNCA P37840 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
ALOX15 P16050 1/20 0.34
PLA2G4A P47712 1/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
HIF1A Q16665 1/20 0.33
REN P00797 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
SCHEMBL9641690 0.87 ABCB11 (0.58) ABCB11ANO1ANO2SMN1; SMN2L3MBTL1
SCHEMBL9641822 0.85 ABCB11 (0.46) ABCB11ANO1ANO2SMN1; SMN2L3MBTL1
SCHEMBL9643531 0.82 ABCB11 (0.52) ABCB11ANO1ANO2SMN1; SMN2L3MBTL1
SCHEMBL9644109 0.82 ABCB11 (0.52) ABCB11ANO1ANO2SMN1; SMN2L3MBTL1
SCHEMBL9643258 0.82 ABCB11 (0.46) ABCB11ANO1ANO2SMN1; SMN2L3MBTL1
SCHEMBL9643254 0.81 ABCB11 (0.51) ABCB11PDE4DALOX15PTGS2
SCHEMBL9643186 0.81 ABCB11 (0.50) ABCB11ANO1ANO2SMN1; SMN2L3MBTL1
SCHEMBL9642515 0.81 ABCB11 (0.50) ABCB11ANO1ANO2SMN1; SMN2L3MBTL1
SCHEMBL9643275 0.80 ABCB11 (0.45) ABCB11PLA2G4A
SCHEMBL9643164 0.75 ABCB11 (0.62) ABCB11SMN1; SMN2L3MBTL1ATMTDP1

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-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
EP-0215622-A2 Naphthalene anti-psoriatic agents and process for making them SYNTEX (U.S.A.) INC. (US) 1987-03-25 EP disclosed