SCHEMBL22754396

SCHEMBL22754396

CN(C)CCCNC(=O)c1ccc(-c2ccc(N)c(NCc3ccc4ncccc4c3)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.51
KDM4E B2RXH2 2/20 0.51
TET3 O43151 1/20 0.51
TET2 Q6N021 1/20 0.51
TET1 Q8NFU7 1/20 0.51
RAD52 P43351 2/20 0.46
UBE2N P61088 1/20 0.46
SYK P43405 6/20 0.46
IKBKB O14920 1/20 0.45
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
AGTR1 P30556 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43

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
SCHEMBL22754398 0.91 L3MBTL1 (0.49) L3MBTL1KDM4ETET3TET2TET1
SCHEMBL21171631 0.90 HDAC6 (0.47) KDM4ESYKALDH1A1HDAC6HDAC1
SCHEMBL24067916 0.87 HDAC6 (0.46) SYKHDAC6HDAC1CYP3A4
SCHEMBL24067886 0.86 HDAC6 (0.44) SYKHDAC6HDAC1MET
SCHEMBL21171387 0.83 MAP4K4 (0.49) IKBKBMAPTHDAC6MAP4K4MET
SCHEMBL21171652 0.83 MAP4K4 (0.48) IKBKBMAPTMAP4K4METCHUK
SCHEMBL22754334 0.82 SYK (0.46) SYKALDH1A1HTTSMN1; SMN2HDAC6
SCHEMBL21171382 0.79 IKBKB (0.45) SYKIKBKBHDAC6PRMT1HDAC1
SCHEMBL21172009 0.79 MET (0.47) SYKMET
SCHEMBL1328548 0.78 MET (0.51) L3MBTL1KDM4ETET3TET2TET1

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 disclosed