SCHEMBL5694502

SCHEMBL5694502

CCCCCc1ccc(NC(=O)c2cccnc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 8/20 0.77
RAB9A P51151 6/20 0.74
NPC1 O15118 5/20 0.74
SMN1; SMN2 Q16637 5/20 0.74
MAPT P10636 2/20 0.67
MEN1 O00255 1/20 0.65
CASP3 P42574 1/20 0.65
KMT2A Q03164 1/20 0.65
SENP8 Q96LD8 1/20 0.65
SENP7 Q9BQF6 1/20 0.65
SENP6 Q9GZR1 1/20 0.65
NPSR1 Q6W5P4 2/20 0.63
GFER P55789 1/20 0.63
GAA P10253 2/20 0.62
ALDH1A1 P00352 2/20 0.60
TP53 P04637 2/20 0.60
NFKB1 P19838 1/20 0.60
NFKB2 Q00653 1/20 0.60
RELA Q04206 1/20 0.60
ROCK2 O75116 1/20 0.59

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
SCHEMBL6055170 0.96 TRPV1 (0.77) TRPV1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL5694495 0.91 RAB9A (0.80) TRPV1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL4374092 0.88 ALDH1A1 (0.64) TRPV1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL21652622 0.88 RAB9A (0.78) TRPV1RAB9ANPC1SMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL4366249 0.87 ALDH1A1 (0.63) TRPV1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL8272789 0.87 ALDH1A1 (0.63) TRPV1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL2864818 0.87 ALDH1A1 (0.63) TRPV1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL2863763 0.87 ALDH1A1 (0.63) TRPV1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL8252721 0.85 RAB9A (1.00) TRPV1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL8867394 0.84 RAB9A (0.72) TRPV1RAB9ANPC1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1259487-A1 2-AMINO-NICOTINAMIDE DERIVATIVES AND THEIR USE AS VEGF-RECEPTOR TYROSINE KINASE INHIBITORS Novartis AG (CH) 2002-11-27 EP claimed
WO-2001055114-A1 2-AMINO-NICOTINAMIDE DERIVATIVES AND THEIR USE AS VEGF-RECEPTOR TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2001-08-02 WO claimed
EP-1682181-A2 COMBINATION OF A VEGF RECEPTOR INHIBITOR WITH A CHEMOTHERAPEUTIC AGENT Novartis AG (CH) 2006-07-26 EP disclosed
EP-1667721-A2 COMBINATIONS OF A VEGF RECEPTOR INHIBITOR WITH OTHER THERAPEUTIC AGENTS Novartis AG (CH) 2006-06-14 EP disclosed
WO-2005027972-A2 COMBINATION OF A VEGF RECEPTOR INHIBITOR WITH A CHEMOTHERAPEUTIC AGENT NOVARTIS AG (CH) 2005-03-31 WO disclosed
WO-2005027973-A2 COMBINATIONS OF A VEGF RECEPTOR INHIBITOR WITH OTHER THERAPEUTIC AGENTS NOVARTIS AG (CH) 2005-03-31 WO disclosed
EP-1259487-A1 2-AMINO-NICOTINAMIDE DERIVATIVES AND THEIR USE AS VEGF-RECEPTOR TYROSINE KINASE INHIBITORS Novartis AG (CH) 2002-11-27 EP disclosed
WO-2001055114-A1 2-AMINO-NICOTINAMIDE DERIVATIVES AND THEIR USE AS VEGF-RECEPTOR TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2001-08-02 WO disclosed