SCHEMBL2659792

SCHEMBL2659792

COCCOc1cc(N(C)S(=O)(=O)c2ccccn2)c2[nH]c(C3=NCCS3)cc2c1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OXTR P30559 1/20 0.32
JAK2 O60674 1/20 0.30
JAK1 P23458 1/20 0.30
TYK2 P29597 1/20 0.30
POLB P06746 1/20 0.30
RAB9A P51151 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
SCHEMBL2968477 0.85 OXTR (0.32) OXTRJAK2JAK1TYK2
SCHEMBL2967653 0.85 OXTR (0.32) OXTRJAK2JAK1TYK2
SCHEMBL2660404 0.85 OXTR (0.32) OXTRJAK2JAK1TYK2
SCHEMBL2660649 0.84
SCHEMBL2975450 0.84 OXTR (0.30) OXTR
SCHEMBL2668694 0.84 OXTR (0.31) OXTRJAK2JAK1TYK2
SCHEMBL2968906 0.84 OXTR (0.31) OXTRJAK2JAK1TYK2
SCHEMBL13327398 0.83 OXTR (0.30) OXTR
SCHEMBL2662013 0.83 JAK2 (0.30) JAK2JAK1TYK2
SCHEMBL2668889 0.83 HTR2B (0.33) JAK2JAK1TYK2

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-2508524-A2 Indole compound Takeda Pharmaceutical Company Limited (JP) 2012-10-10 EP disclosed
EP-2074119-A1 INDOLE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2009-07-01 EP disclosed
WO-2008050821-A1 INDOLE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-05-02 WO disclosed
WO-2008050821-A1 INDOLE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-05-02 WO disclosed