SCHEMBL16634587

SCHEMBL16634587

CCOC(=O)c1ccc(Nc2ccccc2NC(=O)c2c(Cl)cccc2Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.53
RAB9A P51151 3/20 0.53
NPC1 O15118 2/20 0.53
GAA P10253 2/20 0.53
MAPT P10636 6/20 0.52
TP53 P04637 4/20 0.52
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
ALDH1A1 P00352 4/20 0.50
TRPV1 Q8NER1 1/20 0.50
CYP1A2 P05177 1/20 0.50
RXFP1 Q9HBX9 2/20 0.47
MAPK1 P28482 2/20 0.47
HPGD P15428 1/20 0.47
HTT P42858 1/20 0.46
CDC25B P30305 1/20 0.46

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
SCHEMBL1707730 0.79 EGFR (0.66) SMN1; SMN2RAB9ANPC1MAPTTP53
SCHEMBL1706614 0.78 TYK2 (0.67)
SCHEMBL18375950 0.78 ALDH1A1 (0.67) SMN1; SMN2RAB9ANPC1GAAMAPT
SCHEMBL3515174 0.78 PDPK1 (0.52) SMN1; SMN2RAB9ANPC1MAPTTP53
SCHEMBL6900575 0.77 SMN1; SMN2 (0.62) SMN1; SMN2RAB9ANPC1GAAMAPT
SCHEMBL4122902 0.77 TRPV1 (0.65) SMN1; SMN2RAB9ANPC1GAAMAPT
SCHEMBL4778970 0.75 SMN1; SMN2 (0.71) SMN1; SMN2RAB9ANPC1GAAMAPT
SCHEMBL2255472 0.75 MAPK13 (0.60) SMN1; SMN2RAB9ANPC1GAAMAPT
SCHEMBL2685930 0.74 CDC25B (0.71) SMN1; SMN2RAB9ANPC1MAPTTP53
SCHEMBL3627660 0.74 MAPT (0.62) SMN1; SMN2RAB9ANPC1GAAMAPT

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