SCHEMBL22754334

SCHEMBL22754334

CCC(=O)c1ccc(-c2ccc(N)c(NCc3ccc4ncccc4c3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SYK P43405 4/20 0.46
HDAC6 Q9UBN7 1/20 0.45
HDAC3 O15379 1/20 0.42
AR P10275 1/20 0.42
KDR P35968 4/20 0.41
HDAC2 Q92769 2/20 0.40
ALOX15 P16050 1/20 0.40
HTT P42858 1/20 0.40
HDAC1 Q13547 1/20 0.40
PLK1 P53350 1/20 0.40
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MMP9 P14780 1/20 0.39
FLT1 P17948 1/20 0.39
KLKB1 P03952 1/20 0.39
KLK1 P06870 1/20 0.39
PDPK1 O15530 1/20 0.38

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
SCHEMBL21171631 0.84 HDAC6 (0.47) SYKHDAC6HDAC3KDRHDAC2
SCHEMBL21167474 0.83 SYK (0.48) SYKHDAC6HDAC3KDRHDAC2
SCHEMBL24067916 0.83 HDAC6 (0.46) SYKHDAC6HDAC3ARHDAC2
SCHEMBL24067886 0.83 HDAC6 (0.44) SYKHDAC6HDAC3HDAC2HDAC1
SCHEMBL22754358 0.82 SYK (0.47) SYKHDAC6HDAC3KDR
SCHEMBL21167638 0.82 SYK (0.46) SYKHDAC6HDAC3KDRPDPK1
SCHEMBL22754396 0.82 L3MBTL1 (0.51) SYKHDAC6HTTHDAC1ALDH1A1
SCHEMBL22754380 0.82 MET (0.51) SYKHDAC6HDAC3KDRHDAC1
SCHEMBL22754415 0.82 MET (0.42) SYKHDAC6HDAC3KDRPDPK1
SCHEMBL21167387 0.81 SYK (0.48) SYKHDAC3KDRFLT1KLKB1

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