SCHEMBL22729928

SCHEMBL22729928

O=C(NOCCO)c1ccc(-c2ccc3nnn(Cc4cccc5cccnc45)c3n2)cc1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 7/20 0.37
ADORA1 P30542 7/20 0.37
MET P08581 7/20 0.35
DGAT2 Q96PD7 1/20 0.35
ADORA3 P0DMS8 1/20 0.34
RIPK1 Q13546 1/20 0.34
PTGES O14684 1/20 0.32

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
SCHEMBL22729926 0.89 MET (0.36) ADORA2AADORA1METADORA3
SCHEMBL15288815 0.89 MET (0.45) MET
Hydrochloric Acid SCHEMBL15288453 0.88 MET (0.44) MET
SCHEMBL15288305 0.88 MET (0.45) MET
SCHEMBL20530304 0.87 ADORA2A (0.38) ADORA2AADORA1METDGAT2
SCHEMBL22729929 0.85 HDAC6 (0.39) ADORA2AADORA1ADORA3
SCHEMBL22729921 0.84 ADORA2A (0.38) ADORA2AADORA1MET
SCHEMBL22729930 0.81 MET (0.36) MET
SCHEMBL15288378 0.80 MET (0.48) MET
Hydrochloric Acid SCHEMBL15288738 0.79 MET (0.47) MET

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
EP-2831073-B1 NOVEL 3,5-DISUBSTITUED-3H-IMIDAZO[4,5-B]PYRIDINE AND 3,5- DISUBSTITUED -3H-[1,2,3]TRIAZOLO[4,5-B]PYRIDINE COMPOUNDS AS MODULATORS OF C-MET PROTEIN KINASES RHIZEN PHARMACEUTICALS S A (CH) 2020-12-09 EP claimed