SCHEMBL846954

SCHEMBL846954

CCCCCN1CCc2cc(OC(=O)Nc3cnc4ccccc4c3)ccc21

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 13/20 0.45
RAB9A P51151 2/20 0.42
HSD17B10 Q99714 2/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
TSHR P16473 1/20 0.42
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NOTUM Q6P988 1/20 0.41

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
SCHEMBL846419 0.95 ACHE (0.47) TRPV1RAB9AHSD17B10ACHEKDM4E
SCHEMBL846566 0.94 HSD17B10 (0.44) TRPV1RAB9AHSD17B10LMNAPOLB
SCHEMBL846407 0.85 NPC1 (0.47) RAB9AHSD17B10LMNAPOLBTSHR
SCHEMBL846194 0.85 TRPV1 (0.59) TRPV1RAB9AKDM4ENPC1SMN1; SMN2
SCHEMBL846485 0.83 HSD17B10 (0.43) TRPV1RAB9AHSD17B10LMNAPOLB
SCHEMBL846869 0.82 NOTUM (0.50) RAB9AHSD17B10TSHRKDM4ENPC1
SCHEMBL847501 0.82 KDM4E (0.48) RAB9AHSD17B10LMNAPOLBTSHR
SCHEMBL846304 0.80 TRPV1 (0.57) TRPV1RAB9AKDM4ENPC1
SCHEMBL846528 0.79 KDR (0.48) RAB9AHSD17B10LMNAPOLBKDM4E
SCHEMBL846669 0.78 TRPV1 (0.58) TRPV1RAB9AKDM4ENPC1SMN1; SMN2

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-1603883-B1 QUINOLINE-DERIVED AMIDE MODULATORS OF VANILLOID VR1 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2012-03-28 EP claimed