SCHEMBL6537512

SCHEMBL6537512

Cc1cc(NC(=O)c2c(Cl)cccc2Cl)c2nccc(Cl)c2c1C

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 18/20 0.48
JAK2 O60674 14/20 0.47
JAK1 P23458 8/20 0.47
RAB9A P51151 1/20 0.45
TP53 P04637 1/20 0.44
MAPT P10636 1/20 0.44
CYP3A4 P08684 1/20 0.44
CDK9 P50750 1/20 0.43
JAK3 P52333 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
SCHEMBL6537464 0.89 TYK2 (0.46) TYK2JAK2JAK1RAB9ATP53
SCHEMBL6537731 0.86 TYK2 (0.47) TYK2JAK2JAK1RAB9ATP53
SCHEMBL6537350 0.85 TYK2 (0.49) TYK2JAK2JAK1RAB9ATP53
SCHEMBL6538091 0.84 TYK2 (0.43) TYK2JAK2JAK1RAB9ATP53
SCHEMBL6537684 0.82 CYP3A4 (0.48) TYK2JAK2JAK1CYP3A4
SCHEMBL6537390 0.82 TYK2 (0.53) TYK2JAK2JAK1CYP3A4CDK9
SCHEMBL6538029 0.80 TYK2 (0.39) TYK2JAK2JAK1RAB9ATP53
SCHEMBL6537359 0.79 TYK2 (0.51) TYK2JAK2JAK1RAB9ACYP3A4
SCHEMBL6537637 0.77 TYK2 (0.47) TYK2JAK2JAK1RAB9AMAPT
SCHEMBL6538173 0.76 TYK2 (0.48) TYK2JAK2JAK1RAB9ATP53

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0876345-B1 HETEROCYCLIC COMPOUNDS AS H+-ATPASES FUJISAWA PHARMACEUTICAL CO (JP) 2004-08-18 EP disclosed
US-6008230-A TREATING BONE DISEASES CAUSED BY ABNORMAL BONE METABOLISM IN HUMAN BEING OR ANIMALS AS THE INHIBITORS OF BONE RESORPTION OR THE INHIBITORS OF BONE METASTASIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-12-28 US disclosed
EP-0876345-A1 HETEROCYCLIC COMPOUNDS AS H+-ATPASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-11-11 EP disclosed
WO-1997014681-A1 HETEROCYCLIC COMPOUNDS AS H+-ATPASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-04-24 WO disclosed