SCHEMBL8429433

SCHEMBL8429433

CSc1c[nH]nc1-c1cc(Cl)cc(Cl)c1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.34
ALDH1A1 P00352 1/20 0.30
GFER P55789 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL425389 0.75 TSHR (0.35) ALDH1A1GFERRXFP1
SCHEMBL8431291 0.73 PDGFRB (0.38) ALDH1A1
SCHEMBL8427413 0.72 MAPK13 (0.33) ALDH1A1GFERRXFP1
SCHEMBL8427320 0.71 ADORA2A (0.32) ALDH1A1GFERRXFP1
SCHEMBL2124539 0.68 IDO1 (0.44) ALDH1A1
SCHEMBL23294328 0.67 KMO (0.42) ALDH1A1
SCHEMBL16945869 0.66 NOTUM (0.40)
SCHEMBL8429214 0.65 TLR8 (0.30)
SCHEMBL8755909 0.64 MAP4K4 (0.34)
SCHEMBL8431067 0.64

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-5945382-A AND A METHOD OF THEIR PREPARATION BY CHLORINATION OF AN INTERMEDIATE ARYLPYRAZOLE; PROTECTION AGAINST FUNGAL DISEASES IN TOMATO, RICE, AND WHEAT PLANTS RHONE-POULENC AGROCHIMIE (FR) 1999-08-31 US disclosed
EP-0638070-A1 FUNGICIDAL ARYLPYRAZOLES RHONE-POULENC AGROCHIMIE (FR) 1995-02-15 EP disclosed
WO-1993022287-A1 FUNGICIDAL ARYLPYRAZOLES RHONE POULENC AGROCHIMIE (FR) 1993-11-11 WO disclosed