SCHEMBL6536783

SCHEMBL6536783

O=C(Nc1cc(Cl)cc2c(Cl)ccnc12)c1c(Cl)cccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 20/20 0.53
JAK2 O60674 18/20 0.53
JAK1 P23458 11/20 0.53
CYP3A4 P08684 1/20 0.47
CDK9 P50750 1/20 0.45
JAK3 P52333 1/20 0.45

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
SCHEMBL6537972 0.88 TYK2 (0.52) TYK2JAK2JAK1CYP3A4CDK9
SCHEMBL6538189 0.87 TYK2 (0.51) TYK2JAK2JAK1CYP3A4CDK9
SCHEMBL6537359 0.87 TYK2 (0.51) TYK2JAK2JAK1CYP3A4CDK9
SCHEMBL6538073 0.85 TYK2 (0.56) TYK2JAK2JAK1CYP3A4CDK9
SCHEMBL6538167 0.84 PTGES (0.51) TYK2JAK2JAK1CYP3A4
SCHEMBL6537352 0.84 TYK2 (0.51) TYK2JAK2JAK1CDK9JAK3
SCHEMBL6538137 0.82 TYK2 (0.47) TYK2JAK2JAK1CDK9JAK3
SCHEMBL6537403 0.81 CD38 (0.45) TYK2JAK2JAK1CYP3A4
SCHEMBL6537738 0.78 TYK2 (0.41) TYK2JAK2JAK1CDK9JAK3
SCHEMBL6537390 0.77 TYK2 (0.53) TYK2JAK2JAK1CYP3A4CDK9

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