SCHEMBL4384186

SCHEMBL4384186

Cc1nc2cc(NC(=O)c3ccc(-c4ccc(F)c(F)c4)nc3C)ccc2s1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 5/20 0.81
RAB9A P51151 7/20 0.51
NPC1 O15118 6/20 0.51
CASP3 P42574 2/20 0.51
SENP7 Q9BQF6 2/20 0.51
POLB P06746 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.43
ALDH1A1 P00352 2/20 0.43
HTT P42858 1/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
PKM P14618 1/20 0.43
INSR P06213 1/20 0.42
ALK Q9UM73 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
LDHA P00338 1/20 0.42

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
SCHEMBL29386356 0.90 TRPV1 (1.00) TRPV1RAB9ANPC1CASP3SENP7
SCHEMBL4388633 0.90 TRPV1 (1.00) TRPV1RAB9ANPC1CASP3SENP7
SCHEMBL4386354 0.83 TRPV1 (0.76) TRPV1RAB9ANPC1CASP3SENP7
SCHEMBL4384181 0.82 TRPV1 (0.69) TRPV1RAB9ANPC1CASP3SENP7
SCHEMBL5803314 0.80 TRPV1 (0.69) TRPV1RAB9ANPC1CASP3SENP7
SCHEMBL5128895 0.78 TRPV1 (0.78) TRPV1RAB9ANPC1CASP3SENP7
SCHEMBL19174265 0.78 TRPV1 (0.52) TRPV1RAB9ANPC1CASP3SENP7
SCHEMBL4386620 0.77 TRPV1 (0.73) TRPV1RAB9ANPC1CASP3SENP7
SCHEMBL5784275 0.76 TRPV1 (0.62) TRPV1RAB9ANPC1CASP3SENP7
SCHEMBL13544365 0.76 TRPV1 (0.72) TRPV1RAB9ANPC1CASP3SENP7

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1606289-B1 CARBOXAMIDE DERIVATIVES GLAXO GROUP LTD (GB) 2009-12-02 EP claimed
EP-1606289-B1 CARBOXAMIDE DERIVATIVES GLAXO GROUP LTD (GB) 2009-12-02 EP disclosed