SCHEMBL16634676

SCHEMBL16634676

O=C(O)c1ccc(-n2c(=O)[nH]c3ccccc32)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.53
MYC P01106 1/20 0.52
NR4A1 P22736 1/20 0.52
HSP90AA1 P07900 5/20 0.52
LMNA P02545 2/20 0.50
KMT2A Q03164 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
MEN1 O00255 1/20 0.50
MAT2A P31153 1/20 0.46
KDM4E B2RXH2 2/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.43
POLB P06746 1/20 0.42
DAO P14920 1/20 0.42
TNKS O95271 1/20 0.41
AURKA O14965 3/20 0.41
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
TSHR P16473 1/20 0.41
CASP1 P29466 1/20 0.41

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
SCHEMBL16634615 0.84 RORC (0.46) TP53HSP90AA1LMNAKMT2AL3MBTL1
SCHEMBL16634744 0.77 L3MBTL1 (0.55) HSP90AA1LMNAKMT2AL3MBTL1MEN1
SCHEMBL10743256 0.76 KDM4E (0.73) TP53HSP90AA1LMNAKMT2AL3MBTL1
SCHEMBL23119669 0.75 LMNA (0.67) TP53HSP90AA1LMNAKMT2AL3MBTL1
SCHEMBL29367625 0.75 LMNA (0.65) HSP90AA1LMNAKMT2AL3MBTL1MEN1
SCHEMBL699273 0.75 LMNA (0.65) HSP90AA1LMNAKMT2AL3MBTL1MEN1
SCHEMBL5786423 0.72 MYC (0.70) TP53MYCNR4A1KMT2AL3MBTL1
SCHEMBL9559146 0.72 HSP90AA1 (0.62) TP53HSP90AA1LMNAKMT2AL3MBTL1
SCHEMBL30615679 0.71 MAT2A (0.49) HSP90AA1LMNAKMT2AL3MBTL1MEN1
SCHEMBL18919887 0.71 L3MBTL1 (0.57) TP53HSP90AA1LMNAKMT2AL3MBTL1

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
WO-2015052675-A1 SUBSTITUTED DIHYDRO-BENZIMIDAZOLE COMPOUNDS AS ROR GAMMA MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2015-04-16 WO disclosed