SCHEMBL2936137

SCHEMBL2936137

CCC[C@@H]1CSC(c2cc3cc(Cl)cc(NC4CCOCC4)c3[nH]2)=N1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.31
JAK2 O60674 1/20 0.30
JAK1 P23458 1/20 0.30
TYK2 P29597 1/20 0.30
JAK3 P52333 1/20 0.30
PRKAA1 Q13131 1/20 0.30

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
SCHEMBL1277734 0.91 MAPK1 (0.31) MAPK1JAK2JAK1TYK2JAK3
SCHEMBL1277737 0.91 MAPK1 (0.31) MAPK1JAK2JAK1TYK2JAK3
SCHEMBL1278419 0.91 MAPK1 (0.31) MAPK1JAK2JAK1TYK2JAK3
SCHEMBL1278417 0.91 MAPK1 (0.31) MAPK1JAK2JAK1TYK2JAK3
SCHEMBL1277343 0.89 MAPK1 (0.30) MAPK1
SCHEMBL1277340 0.89 MAPK1 (0.30) MAPK1
SCHEMBL1278084 0.89 HTR2B (0.32) MAPK1JAK2JAK1TYK2JAK3
SCHEMBL1278081 0.89 HTR2B (0.32) MAPK1JAK2JAK1TYK2JAK3
SCHEMBL1277772 0.87 MAPK1 (0.31) MAPK1JAK2JAK1TYK2JAK3
SCHEMBL1277776 0.87 MAPK1 (0.31) MAPK1JAK2JAK1TYK2JAK3

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
EP-2220081-A2 GLUCOKINASE ACTIVATORS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS AN ACTIVE INGREDIENT LG Life Sciences Ltd. (KR) 2010-08-25 EP disclosed
WO-2009082152-A2 GLUCOKINASE ACTIVATORS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS AN ACTIVE INGREDIENT LG LIFE SCIENCES LTD. (KR) 2009-07-02 WO disclosed