SCHEMBL9941995

SCHEMBL9941995

CC(C)(C)C(=O)NCc1ccc(Cl)c(Nc2nc3cc(C(=O)NC4CCC(C(F)(F)F)CC4)c(N4CCC(C(F)(F)F)CC4)nc3n2C2CC2)c1Cl

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGES O14684 20/20 0.71

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
SCHEMBL14233871 1.00 PTGES (0.71) PTGES
SCHEMBL14119005 0.92 PTGES (0.79) PTGES
SCHEMBL9942043 0.92 PTGES (0.79) PTGES
SCHEMBL14118762 0.89 PTGES (0.76) PTGES
SCHEMBL9942009 0.89 PTGES (0.76) PTGES
SCHEMBL14233333 0.89 PTGES (0.68) PTGES
SCHEMBL9942004 0.89 PTGES (0.79) PTGES
SCHEMBL14233332 0.89 PTGES (0.69) PTGES
SCHEMBL14233329 0.89 PTGES (0.79) PTGES
SCHEMBL14233328 0.87 PTGES (0.80) PTGES

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-2012076674-A1 IMIDAZO(4,5-B)PYRIDINE-6-CARBOXAMIDES AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-14 WO disclosed