SCHEMBL8083996

SCHEMBL8083996

CO/C=C(/C(=O)O)c1ccccc1COc1cccc(C2CC2c2ccccc2)c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 6/20 0.41
KDM1A O60341 1/20 0.39
NPC1 O15118 1/20 0.37
NR4A2 P43354 1/20 0.37
RAB9A P51151 1/20 0.37
GRIN1 Q05586 3/20 0.36
SCN3A Q9NY46 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36

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
SCHEMBL8083999 1.00 HIF1A (0.41) HIF1AKDM1ANPC1NR4A2RAB9A
SCHEMBL8079208 0.92 HIF1A (0.47) HIF1AKDM1ASCN3A
SCHEMBL8079209 0.92 HIF1A (0.47) HIF1AKDM1ASCN3A
SCHEMBL8082315 0.90 HIF1A (0.36) HIF1AGRIN1
SCHEMBL8082320 0.90 HIF1A (0.36) HIF1AGRIN1
SCHEMBL8077602 0.88 HIF1A (0.39) HIF1AKDM1ANPC1NR4A2RAB9A
SCHEMBL8077603 0.88 HIF1A (0.39) HIF1AKDM1ANPC1NR4A2RAB9A
SCHEMBL8077647 0.86 HIF1A (0.36) HIF1ANPC1NR4A2RAB9A
SCHEMBL6934748 0.85 HIF1A (0.39) HIF1AKDM1AGRIN1
SCHEMBL6933903 0.84 HIF1A (0.35) HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0889024-B1 Benzyloxy substituted aromatics and their use as fungicides and insecticides ROHM & HAAS (US) 2000-09-13 EP disclosed
EP-0889024-A1 Benzyloxy substituted aromatics and their use as fungicides and insecticides ROHM AND HAAS COMPANY (US) 1999-01-07 EP disclosed