SCHEMBL22729945

SCHEMBL22729945

CC(C)(CO)ONC(=O)c1ccc(-c2ccc3nnn(Cc4cccc5cccnc45)c3n2)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 4/20 0.36
ALDH1A1 P00352 3/20 0.34
LMNA P02545 2/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34
SLC16A3 O15427 1/20 0.34
SLC16A1 P53985 1/20 0.34
ADORA2A P29274 4/20 0.34
ADORA1 P30542 4/20 0.34
PPARG P37231 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
KDR P35968 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33

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
SCHEMBL22729940 0.92 MET (0.35) METALDH1A1MAPTADORA2AADORA1
SCHEMBL15288646 0.88 MET (0.47) MET
SCHEMBL22729926 0.87 MET (0.36) METALDH1A1MAPTHPGDNPSR1
SCHEMBL20530335 0.87 MET (0.47) METADORA2AADORA1PPARGMEN1
SCHEMBL20530311 0.86 GPR119 (0.40) METLMNAMAPTADORA2AADORA1
SCHEMBL22729947 0.85 MET (0.36) METALDH1A1LMNAHPGDADORA2A
SCHEMBL20530328 0.84 MKNK2 (0.39) METADORA2AADORA1MEN1KMT2A
SCHEMBL20530346 0.84 POLB (0.38) METHPGDADORA2AADORA1MEN1
SCHEMBL20530288 0.83 HPGD (0.46) METALDH1A1HPGDNPSR1MEN1
SCHEMBL20530314 0.82 KDR (0.37) METALDH1A1MAPTHPGDNPSR1

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