SCHEMBL7684280

SCHEMBL7684280

COC(=O)c1c(Cl)cccc1NC(=O)c1ccc(C)nc1C(=O)NCC1CC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 15/20 0.43
CNR2 P34972 13/20 0.43
PAK1 Q13153 1/20 0.40
P2RX7 Q99572 1/20 0.40
CHRM1 P11229 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL7682637 0.90 CNR1 (0.45) CNR1CNR2CYP3A4CYP2C9
SCHEMBL7675273 0.87 P2RX7 (0.39) CNR1CNR2PAK1P2RX7NPC1
SCHEMBL7679306 0.85 ALDH1A1 (0.40) NPC1
SCHEMBL678914 0.85 P2RX7 (0.38) CNR1CNR2PAK1P2RX7CHRM1
SCHEMBL7682836 0.85 KDM4E (0.39) P2RX7NPC1
SCHEMBL7686045 0.84 HPGD (0.44) CNR1CNR2NPC1
SCHEMBL7677391 0.83 CNR1 (0.38) CNR1CNR2PAK1P2RX7CYP3A4
SCHEMBL7685451 0.83 CNR1 (0.43) CNR1CNR2PAK1P2RX7CHRM1
SCHEMBL7682078 0.82 ALDH1A1 (0.42) NPC1
SCHEMBL7676296 0.81 PTGER4 (0.40) CNR1CNR2PAK1P2RX7NPC1

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-6472349-B1 Pyridine-2,3-dicarboxylic acid diamides BASF AKTIENGESELLSCHAFT (DE) 2002-10-29 US claimed