SCHEMBL14148014

SCHEMBL14148014

O=C(NCc1cccc2cnccc12)c1ccc2cc(C(F)(F)F)ccc2c1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.52
TRPV1 Q8NER1 10/20 0.51
DGAT2 Q96PD7 3/20 0.49
TP53 P04637 1/20 0.48
ROCK2 O75116 4/20 0.47
PPARD Q03181 1/20 0.46

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
SCHEMBL14147966 0.88 TRPV1 (0.48) AKT1TRPV1DGAT2TP53ROCK2
SCHEMBL14148032 0.85 TRPV1 (0.48) TRPV1DGAT2
SCHEMBL14147719 0.80 TRPV1 (0.49) AKT1TRPV1DGAT2TP53ROCK2
SCHEMBL265347 0.80 NAMPT (0.43) TRPV1DGAT2ROCK2
SCHEMBL264842 0.80 NAMPT (0.43) TRPV1DGAT2ROCK2
SCHEMBL4787180 0.79 FLT1 (0.48) TRPV1DGAT2TP53PPARD
SCHEMBL4021187 0.77 TRPV1 (0.57) TRPV1DGAT2
SCHEMBL14147888 0.77 TRPV1 (0.49) TRPV1DGAT2ROCK2
SCHEMBL4021335 0.76 ROS1 (0.55) TRPV1DGAT2
SCHEMBL13332063 0.76 TRPV1 (0.57) TRPV1

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
WO-2008090434-A1 SUBSTITUTED N-BICYCLICALKYL BICYCLIC CARBOXYAMIDE COMPOUNDS PFIZER JAPAN INC. (JP) 2008-07-31 WO disclosed