SCHEMBL2860192

SCHEMBL2860192

CS(=O)(=O)c1cccc(N(Cc2ccccc2)C(=O)c2cnn(-c3ccc(Cl)cc3)c2C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 5/20 0.50
KEAP1 Q14145 2/20 0.44
NFE2L2 Q16236 2/20 0.44
MAPT P10636 2/20 0.44
KMT2A Q03164 3/20 0.44
ATF1 P18846 1/20 0.43
NFKB1 P19838 1/20 0.43
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 2/20 0.42
HSP90AA1 P07900 1/20 0.42
MAPK1 P28482 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
KDM4E B2RXH2 1/20 0.41
RAB9A P51151 1/20 0.39

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
SCHEMBL2859852 0.90 CCR1 (0.49) CCR1KEAP1NFE2L2MAPTKMT2A
SCHEMBL2850444 0.87 CCR1 (0.46) CCR1KEAP1NFE2L2MAPTKMT2A
SCHEMBL2854294 0.87 CCR1 (0.48) CCR1KEAP1NFE2L2MAPTKMT2A
SCHEMBL2857725 0.85 MAPT (0.52) CCR1KEAP1NFE2L2MAPTKMT2A
SCHEMBL2854321 0.79 MAPT (0.53) CCR1KEAP1NFE2L2MAPTKMT2A
SCHEMBL2854667 0.78 ALDH1A1 (0.55) CCR1MAPTKMT2APOLBSMN1; SMN2
SCHEMBL13513684 0.75 CCR1 (0.54) CCR1KEAP1NFE2L2MAPTKMT2A
SCHEMBL2854529 0.74 MAPT (0.47) CCR1MAPTKMT2APOLBSMN1; SMN2
SCHEMBL2850211 0.74 MAPT (0.49) CCR1KEAP1NFE2L2MAPTKMT2A
SCHEMBL2862087 0.74 MAPT (0.51) CCR1KEAP1NFE2L2MAPTKMT2A

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
EP-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP disclosed