SCHEMBL846740

SCHEMBL846740

CCCN(C)c1ccc(C(=O)Nc2cnc3ccccc3c2)c(Cl)c1

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 12/20 0.72
KDR P35968 5/20 0.59
TMPRSS4 Q9NRS4 1/20 0.53
KDM4E B2RXH2 1/20 0.52
LMNA P02545 1/20 0.52
POLB P06746 1/20 0.52
TSHR P16473 1/20 0.52
RAB9A P51151 1/20 0.52
HSD17B10 Q99714 1/20 0.52

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
SCHEMBL846237 0.93 TRPV1 (0.74) TRPV1KDRTMPRSS4
SCHEMBL846826 0.85 KDR (0.58) TRPV1KDRTMPRSS4KDM4ERAB9A
SCHEMBL846453 0.84 TRPV1 (1.00) TRPV1KDRKDM4ERAB9A
SCHEMBL846423 0.83 TRPV1 (0.75) TRPV1KDRTMPRSS4KDM4E
SCHEMBL846181 0.82 TRPV1 (0.80) TRPV1KDRKDM4ERAB9A
SCHEMBL846029 0.81 KDR (0.61) TRPV1KDRTMPRSS4KDM4ELMNA
SCHEMBL845817 0.79 TRPV1 (0.74) TRPV1KDRTMPRSS4KDM4ERAB9A
SCHEMBL846437 0.79 KDR (0.58) TRPV1KDRTMPRSS4POLB
SCHEMBL846608 0.78 KDR (0.65) TRPV1KDRTMPRSS4KDM4ETSHR
SCHEMBL845760 0.78 TRPV1 (1.00) TRPV1KDRKDM4ERAB9A

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