SCHEMBL847040

SCHEMBL847040

CCCn1ccc2cc(C(=O)Nc3cnc4ccccc4c3)ccc21

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 15/20 0.61
NPC1 O15118 2/20 0.57
RAB9A P51151 2/20 0.57
KDM4E B2RXH2 1/20 0.57
MITF O75030 1/20 0.57
XBP1 P17861 1/20 0.57
PAX8 Q06710 1/20 0.57
KLF5 Q13887 1/20 0.57
KDR P35968 3/20 0.56
ALDH1A1 P00352 1/20 0.53

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
SCHEMBL846662 0.93 TRPV1 (0.62) TRPV1NPC1RAB9AKDM4EMITF
SCHEMBL846206 0.82 MEN1 (0.55) TRPV1RAB9AKDM4E
SCHEMBL879569 0.82 TRPV1 (0.57) TRPV1NPC1RAB9AKDM4EMITF
SCHEMBL846031 0.81 IRAK4 (0.43) TRPV1NPC1RAB9AKDM4EALDH1A1
SCHEMBL846132 0.81 BCHE (0.45)
SCHEMBL846663 0.77 TRPV1 (0.48) TRPV1RAB9A
SCHEMBL846901 0.76 TRPV1 (0.61) TRPV1NPC1RAB9AKDM4EMITF
SCHEMBL846554 0.76 TRPV1 (1.00) TRPV1NPC1RAB9AKDM4EMITF
SCHEMBL846316 0.76 TRPV1 (0.82) TRPV1NPC1RAB9AKDM4EMITF
SCHEMBL846453 0.75 TRPV1 (1.00) TRPV1NPC1RAB9AKDM4EMITF

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-1603883-B1 QUINOLINE-DERIVED AMIDE MODULATORS OF VANILLOID VR1 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2012-03-28 EP disclosed
EP-2308848-A1 Quinoline-derived amide modulators of vanilloid VR1 receptor Janssen Pharmaceutica NV (BE) 2011-04-13 EP disclosed