SCHEMBL6646555

SCHEMBL6646555

NC(=O)N(c1cccc(C(F)(F)F)c1)c1ccc(N2C=Cc3sccc3C2N)cc1F

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ UBE2M P61081 1/20 0.30
▸ DCUN1D1 Q96GG9 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
SCHEMBL6686235 0.75 ALOX15 (0.32) MAPK8
SCHEMBL27747320 0.71 MPO (0.39) —
SCHEMBL4826385 0.68 — —
SCHEMBL5606524 0.67 CES2 (0.50) —
SCHEMBL6687438 0.66 RORB (0.33) L3MBTL1
SCHEMBL4831103 0.66 NPSR1 (0.30) —
SCHEMBL6440646 0.64 GRIK1 (0.44) —
SCHEMBL28217598 0.64 PTGIR (0.46) —
SCHEMBL7621277 0.64 MEN1 (0.41) —
SCHEMBL27721413 0.64 P2RX1 (0.43) —

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-1487841-A1 THIOPYRIMIDINE AND ISOTHIAZOLOPYRIMIDINE KINASE INHIBITORS Abbott Laboratories (US) 2004-12-22 — — EP claimed
WO-2003080625-A1 THIOPYRIMIDINE AND ISOTHIAZOLOPYRIMIDINE KINASE INHIBITORS ABBOTT LABORATORIES (US) 2003-10-02 — — WO claimed
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