SCHEMBL7682768

SCHEMBL7682768

CNC(=O)C(=NOC)c1ccccc1COc1ncc(C(F)(F)F)cc1F

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.51
HCRTR1 O43613 6/20 0.39
MRGPRX4 Q96LA9 3/20 0.38
HCRTR2 O43614 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 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
SCHEMBL7682766 1.00 HIF1A (0.51) HIF1AHCRTR1MRGPRX4HCRTR2KDM4E
SCHEMBL7685375 0.91 HIF1A (0.52) HIF1AMRGPRX4
SCHEMBL7685378 0.91 HIF1A (0.52) HIF1AMRGPRX4
SCHEMBL8370602 0.90 HIF1A (0.50) HIF1AMRGPRX4KDM4EHPGD
SCHEMBL8370605 0.90 HIF1A (0.50) HIF1AMRGPRX4KDM4EHPGD
SCHEMBL8371691 0.83 HIF1A (0.51) HIF1AMRGPRX4HPGD
SCHEMBL8780155 0.83 HIF1A (0.51) HIF1AMRGPRX4HPGD
SCHEMBL8371689 0.83 HIF1A (0.51) HIF1AMRGPRX4HPGD
SCHEMBL829099 0.82 HIF1A (0.46) HIF1AMRGPRX4
SCHEMBL829098 0.82 HIF1A (0.46) HIF1AMRGPRX4

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
US-6372766-B1 FUNGICIDES AND ANTIGROWTH AGENTS BASF AKTIENGESELLSCHAFT (DE) 2002-04-16 US disclosed
EP-1027334-A1 SUBSTITUTED 2-(2'-PYRIDYLOXY)PHENYL ACETAMIDES AS FUNGICIDES AND PESTICIDES BASF AKTIENGESELLSCHAFT (DE) 2000-08-16 EP disclosed
WO-1999021833-A1 SUBSTITUTED 2-(2'-PYRIDYLOXY)PHENYL ACETAMIDES AS FUNGICIDES AND PESTICIDES BASF AKTIENGESELLSCHAFT (DE) 1999-05-06 WO disclosed