SCHEMBL9640959

SCHEMBL9640959

C(=Cc1ccccc1)CC1=Cc2ccccc2OC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 5/20 0.37
PTGS2 P35354 5/20 0.37
PTGER4 P35408 1/20 0.37
PTGER3 P43115 1/20 0.37
PTGER2 P43116 1/20 0.37
ALOX5 P09917 1/20 0.36
NISCH Q9Y2I1 1/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
IDO1 P14902 2/20 0.35
PAM P19021 1/20 0.35
MAOB P27338 1/20 0.35
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL9642215 0.82 PTGS1 (0.38) PTGS1PTGS2ALOX5NPC1GAA
SCHEMBL9642269 0.78 PTGS1 (0.44) PTGS1PTGS2ALOX5KDM4ENPC1
SCHEMBL17705386 0.76 PTGS1 (0.51) PTGS1PTGS2ALOX5NISCHKDM4E
SCHEMBL9640961 0.74 PTGS1 (0.50) PTGS1PTGS2ALOX5NISCHKDM4E
SCHEMBL28667713 0.72 IDO1 (0.35) PTGER4PTGER3PTGER2KDM4EMAPT
SCHEMBL14013661 0.71 ALOX5 (0.41) PTGS1PTGS2ALOX5NISCHKDM4E
SCHEMBL7294523 0.71 ALOX5 (0.42) PTGS1PTGS2ALOX5NISCHKDM4E
SCHEMBL9731627 0.71 ALOX5 (0.46) PTGS1PTGS2ALOX5NISCHKDM4E
SCHEMBL3726729 0.71 ALOX5 (0.46) PTGS1PTGS2ALOX5NISCHKDM4E
SCHEMBL30529006 0.71 ALOX5 (0.46) PTGS1PTGS2ALOX5NISCHKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0338895-B1 HETEROAROTINOID DERIVATIVES, THEIR PROCESSES OF PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ADIR (FR) 1992-09-23 EP claimed