SCHEMBL2855797

SCHEMBL2855797

CCCc1c(OC(=O)NCCc2ccc(C)c(C)c2)cnn1-c1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.47
MAPK14 Q16539 4/20 0.44
MAPT P10636 2/20 0.42
LMNA P02545 1/20 0.40
PKM P14618 1/20 0.40
ABCB1 P08183 1/20 0.40
SMO Q99835 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38
GAA P10253 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CNR2 P34972 1/20 0.37

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
SCHEMBL2856900 0.91 MAPT (0.47) CNR1MAPK14MAPTLMNAPKM
SCHEMBL2853296 0.91 MAPK14 (0.47) MAPK14MAPTLMNAPKMGAA
SCHEMBL2858349 0.90 CNR1 (0.44) CNR1MAPK14MAPTLMNAPKM
SCHEMBL2856544 0.88 ABCB1 (0.53) CNR1LMNAABCB1GAASMN1; SMN2
SCHEMBL2850361 0.88 ABCB1 (0.48) CNR1MAPTLMNAPKMABCB1
SCHEMBL2848346 0.87 MAPT (0.55) CNR1MAPTLMNAPKMNPSR1
SCHEMBL2857882 0.87 MAPT (0.43) CNR1MAPK14MAPTLMNAPKM
SCHEMBL2856513 0.87 TAAR1 (0.51) MAPTLMNAPKMABCB1TAAR1
SCHEMBL2860461 0.87 TAAR1 (0.54) CNR1MAPTLMNAPKMABCB1
SCHEMBL2850486 0.86 MAPT (0.46) MAPK14MAPTLMNAPKMABCB1

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 claimed