SCHEMBL486079

SCHEMBL486079

O=C(NC1CC(c2ccc(C(F)(F)F)cc2)CN(C2CCC(O)CC2)C1)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F2R P25116 8/20 0.69
CCR2 P41597 9/20 0.52
KCNH2 Q12809 6/20 0.52
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CHRM1 P11229 1/20 0.45

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
SCHEMBL662957 0.84 F2R (0.76) F2RCCR2MEN1KMT2ACHRM1
SCHEMBL661933 0.82 F2R (1.00) F2RCCR2MEN1KMT2ACHRM1
SCHEMBL662583 0.81 F2R (0.85) F2RCCR2MEN1KMT2A
SCHEMBL10242108 0.79 F2R (0.91) F2RCCR2MEN1KMT2A
SCHEMBL485918 0.78 F2R (0.62) F2RMEN1KMT2ACHRM1
SCHEMBL486313 0.76 F2R (1.00) F2RMEN1KMT2A
SCHEMBL10239963 0.76 F2R (1.00) F2RMEN1KMT2A
SCHEMBL661361 0.76 F2R (0.65) F2RMEN1KMT2A
SCHEMBL663324 0.75 F2R (0.64) F2RCCR2MEN1KMT2A
SCHEMBL485929 0.75 F2R (0.84) F2RCCR2MEN1KMT2A

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-2411363-A1 SUBSTITUTED PIPERIDINES AS PAR-1 ANTAGONISTS Bayer Pharma AG (DE) 2012-02-01 EP disclosed
WO-2010108608-A1 SUBSTITUTED PIPERIDINES AS PAR-1 ANTAGONISTS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-09-30 WO disclosed