SCHEMBL6936973

SCHEMBL6936973

CO/C=C(/C(=O)O)c1ccccc1COc1cccc([C@@H]2C[C@H]2CCCCCCC=NOC)c1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 7/20 0.40
FFAR1 O14842 8/20 0.36
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
ALOX5 P09917 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
SCHEMBL8083999 0.81 HIF1A (0.41) HIF1ACHRM2CHRM1CHRM3
SCHEMBL8083996 0.81 HIF1A (0.41) HIF1ACHRM2CHRM1CHRM3
SCHEMBL6934748 0.78 HIF1A (0.39) HIF1AALOX5
SCHEMBL8077602 0.77 HIF1A (0.39) HIF1AFFAR1
SCHEMBL8077603 0.77 HIF1A (0.39) HIF1AFFAR1
SCHEMBL8077647 0.76 HIF1A (0.36) HIF1AFFAR1
SCHEMBL6933907 0.76 HIF1A (0.35) HIF1AFFAR1
SCHEMBL6933903 0.76 HIF1A (0.35) HIF1AFFAR1
SCHEMBL8082315 0.74 HIF1A (0.36) HIF1A
SCHEMBL8082320 0.74 HIF1A (0.36) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1050528-B1 Fungicidal and insecticidal benzyloxy cyclopropyl substituted aromatic compounds DOW AGROSCIENCES LLC (US) 2003-01-22 EP disclosed
US-6335367-B1 Fungicidal and insecticidal benzyloxy cyclopropyl substituted aromatic compounds DOW AGROSCIENCES LLC 2002-01-01 US disclosed
EP-1050528-A1 Fungicidal and insecticidal benzyloxy cyclopropyl substituted aromatic compounds ROHM AND HAAS COMPANY (US) 2000-11-08 EP disclosed