SCHEMBL5265547

SCHEMBL5265547

N#Cc1cc(C(=O)O)c(C(F)(F)F)nc1N1CCN(C(=O)NS(=O)(=O)c2ccc(Cl)cc2)CC1

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 20/20 0.78

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
SCHEMBL4103116 0.92 P2RY12 (0.78) P2RY12
SCHEMBL5599505 0.91 P2RY12 (0.81) P2RY12
SCHEMBL4099479 0.88 P2RY12 (1.00) P2RY12
SCHEMBL4117515 0.81 P2RY12 (1.00) P2RY12
SCHEMBL4107044 0.81 P2RY12 (1.00) P2RY12
SCHEMBL4105133 0.80 P2RY12 (1.00) P2RY12
SCHEMBL5266275 0.80 P2RY12 (0.86) P2RY12
SCHEMBL3922603 0.79 P2RY12 (0.77) P2RY12
SCHEMBL3922179 0.77 P2RY12 (0.80) P2RY12
SCHEMBL3926625 0.76 P2RY12 (0.67) P2RY12

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-1836189-A1 NOVEL PYRIDINE COMPOUNDS AstraZeneca AB (SE) 2007-09-26 EP disclosed
WO-2006073361-A1 NOVEL PYRIDINE COMPOUNDS ASTRAZENECA AB (SE) 2006-07-13 WO disclosed