SCHEMBL9735903

SCHEMBL9735903

COCC1(C)C=C(OC2=CC(=O)CC2)c2cc(C(=O)OC)ccc2O1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.36
CNR1 P21554 2/20 0.35
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
ALOX5 P09917 1/20 0.35
RAB9A P51151 4/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
MAPT P10636 3/20 0.34
POLB P06746 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MCL1 Q07820 1/20 0.33
NPC1 O15118 1/20 0.33
NPSR1 Q6W5P4 2/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
PDK2 Q15119 1/20 0.32
CASP3 P42574 1/20 0.32
OPRD1 P41143 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
SCHEMBL9736109 0.80 CNR2 (0.35) CNR2CNR1CA12CA9ALOX5
SCHEMBL9735336 0.79 ALOX5 (0.36) CNR2CNR1CA12CA9ALOX5
SCHEMBL9735503 0.78 ALOX5 (0.35) CNR2CNR1CA12CA9ALOX5
SCHEMBL9735371 0.74 ALDH1A1 (0.37) ALOX5RAB9ASMN1; SMN2MAPTPOLB
SCHEMBL9737241 0.71 CA12 (0.36) CNR2CA12CA9ALOX5RAB9A
SCHEMBL9736905 0.71 ALOX5 (0.39) CNR2CNR1ALOX5RAB9ASMN1; SMN2
SCHEMBL9735212 0.69 CA12 (0.34) CNR2CA12CA9ALOX5RAB9A
SCHEMBL9845023 0.65 CA12 (0.34) CNR2CA12CA9ALOX5RAB9A
SCHEMBL9443581 0.65 CA12 (0.38) CNR2CA12CA9ALOX5RAB9A
SCHEMBL670503 0.65 MAPT (0.61) CA12CA9ALOX5RAB9ASMN1; SMN2

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
US-5130322-A CHROMAN DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-07-14 US disclosed