SCHEMBL9643306

SCHEMBL9643306

COc1c(OC)c(OC(C)=O)c2ccc(OC(C)c3ccccc3)cc2c1O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 1/20 0.46
PDE4A P27815 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44
IGLV6-57 P01721 1/20 0.42
BACE1 P56817 3/20 0.42
FFAR1 O14842 1/20 0.41
LTB4R Q15722 6/20 0.40
LTB4R2 Q9NPC1 6/20 0.40
ALOX5 P09917 1/20 0.39
KDM4E B2RXH2 1/20 0.39
TP53 P04637 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL9643227 0.95 ABCB11 (0.46) ABCB11PDE4APDE4BPDE4CPDE4D
SCHEMBL9641905 0.93 ABCB11 (0.53) ABCB11PDE4APDE4BPDE4CPDE4D
SCHEMBL9643550 0.82 ABCB11 (0.57) ABCB11PDE4APDE4BPDE4CPDE4D
SCHEMBL9643340 0.82 ABCB11 (0.43) ABCB11PDE4APDE4BPDE4CPDE4D
SCHEMBL9713770 0.81 HTT (0.44) ABCB11IGLV6-57BACE1FFAR1LTB4R
SCHEMBL9642983 0.78 PDE4A (0.53) ABCB11PDE4APDE4BPDE4CPDE4D
SCHEMBL9643309 0.77 ABCB11 (0.44) ABCB11BACE1FFAR1ALOX5
SCHEMBL9642480 0.77 ABCB11 (0.57) ABCB11PDE4APDE4BPDE4CPDE4D
SCHEMBL9642268 0.77 ABCB11 (0.55) ABCB11PDE4APDE4BPDE4CPDE4D
SCHEMBL9642660 0.74 ABCB11 (0.57) ABCB11PDE4APDE4BPDE4CPDE4D

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