SCHEMBL7685378

SCHEMBL7685378

CNC(=O)C(=NOC)c1ccccc1COc1ncc(C(F)(F)F)cc1C

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.52
MRGPRX4 Q96LA9 3/20 0.38
SSTR4 P31391 1/20 0.36
OPRL1 P41146 1/20 0.36
SCN9A Q15858 1/20 0.35
LMNA P02545 1/20 0.35
ULK1 O75385 1/20 0.35
AGBL2 Q5U5Z8 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34

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
SCHEMBL7685375 1.00 HIF1A (0.52) HIF1AMRGPRX4SSTR4OPRL1SCN9A
SCHEMBL7682768 0.91 HIF1A (0.51) HIF1AMRGPRX4
SCHEMBL7682766 0.91 HIF1A (0.51) HIF1AMRGPRX4
SCHEMBL8370605 0.91 HIF1A (0.50) HIF1AMRGPRX4SCN9ALMNA
SCHEMBL8370602 0.91 HIF1A (0.50) HIF1AMRGPRX4SCN9ALMNA
SCHEMBL8341966 0.86 HIF1A (0.46) HIF1AOPRL1LMNA
SCHEMBL8341964 0.86 HIF1A (0.46) HIF1AOPRL1LMNA
SCHEMBL8371689 0.84 HIF1A (0.51) HIF1AMRGPRX4SCN9ALMNA
SCHEMBL8371691 0.84 HIF1A (0.51) HIF1AMRGPRX4SCN9ALMNA
SCHEMBL8780155 0.84 HIF1A (0.51) HIF1AMRGPRX4SCN9ALMNA

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-6372766-B1 FUNGICIDES AND ANTIGROWTH AGENTS BASF AKTIENGESELLSCHAFT (DE) 2002-04-16 US disclosed