SCHEMBL13754010

SCHEMBL13754010

CCNC(=O)c1ccccc1Nc1cccc(C(F)(F)F)c1

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 14/20 0.73
YAP1 P46937 1/20 0.66
TEAD4 Q15561 1/20 0.66
TEAD2 Q15562 1/20 0.66
TRPV1 Q8NER1 1/20 0.57
LMNA P02545 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56

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
SCHEMBL9268782 0.86 RXFP1 (0.78) RXFP1YAP1TEAD4TEAD2LMNA
SCHEMBL1774875 0.85 RXFP1 (0.70) RXFP1YAP1TEAD4TEAD2TRPV1
SCHEMBL1776064 0.85 RXFP1 (0.63) RXFP1YAP1TEAD4TEAD2TRPV1
SCHEMBL1775112 0.85 RXFP1 (0.65) RXFP1YAP1TEAD4TEAD2TRPV1
SCHEMBL14853341 0.85 YAP1 (0.77) RXFP1YAP1TEAD4TEAD2LMNA
SCHEMBL10516305 0.84 RXFP1 (0.80) RXFP1YAP1TEAD4TEAD2LMNA
SCHEMBL15528884 0.84 RXFP1 (1.00) RXFP1
SCHEMBL1774632 0.84 RXFP1 (0.60) RXFP1YAP1TEAD4TEAD2TRPV1
SCHEMBL12606017 0.83 RXFP1 (0.67) RXFP1YAP1TEAD4TEAD2TRPV1
SCHEMBL12851592 0.83 RXFP1 (0.78) RXFP1YAP1TEAD4TEAD2LMNA

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
US-7576117-B1 Cyclic amine CCR3 antagonist TEIJIN LIMITED (JP) 2009-08-18 US disclosed
US-7576117-B1 Cyclic amine CCR3 antagonist TEIJIN LIMITED (JP) 2009-08-18 US disclosed