SCHEMBL20530288

SCHEMBL20530288

O=C(NC1CC1)c1ccc(-c2ccc3nnn(Cc4cccc5cccnc45)c3n2)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.46
GAA P10253 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TSHR P16473 2/20 0.42
ALDH1A1 P00352 1/20 0.42
HTT P42858 1/20 0.42
USP2 O75604 1/20 0.39
CNR1 P21554 5/20 0.39
CNR2 P34972 5/20 0.39
PDE4B Q07343 8/20 0.38
PDE4D Q08499 4/20 0.38
MET P08581 1/20 0.37
DRD4 P21917 1/20 0.37

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
SCHEMBL20530369 0.91 MET (0.44) HPGDGAANPSR1CNR1CNR2
SCHEMBL20530335 0.90 MET (0.47) MEN1KMT2AMET
SCHEMBL20530346 0.88 POLB (0.38) HPGDMEN1KMT2ATSHRPDE4B
SCHEMBL20530311 0.88 GPR119 (0.40) MEN1KMT2APDE4BMET
SCHEMBL20530319 0.88 MET (0.43) HPGDMEN1KMT2ATSHRALDH1A1
SCHEMBL20530322 0.88 MET (0.43) HPGDMEN1KMT2ATSHRALDH1A1
SCHEMBL20530296 0.87 CNR1 (0.43) HPGDMEN1KMT2ATSHRALDH1A1
SCHEMBL20530328 0.87 MKNK2 (0.39) MEN1KMT2AMET
SCHEMBL1330786 0.86 MET (0.51) MET
SCHEMBL22729926 0.85 MET (0.36) HPGDGAANPSR1MEN1KMT2A

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-2571878-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 PROTEIN KINASES INCOZEN THERAPEUTICS PVT LTD (IN) 2018-10-17 EP claimed