SCHEMBL14312676

SCHEMBL14312676

Cc1csc(-c2ncc(OC(=O)Nn3cc(C(F)F)c4cnccc43)c(C)n2)n1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 4/20 0.32
▸ TGFBR2 P37173 2/20 0.32
▸ HPGDS O60760 1/20 0.31

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
SCHEMBL14312836 0.93 TGFBR1 (0.32) TGFBR1TGFBR2
SCHEMBL14313407 0.93 HPGDS (0.30) HPGDS
SCHEMBL14313154 0.93 NTRK1 (0.31) TGFBR1TGFBR2
SCHEMBL14313327 0.89 HPGDS (0.31) HPGDS
SCHEMBL14313194 0.89 HPGDS (0.36) TGFBR1TGFBR2HPGDS
SCHEMBL14312622 0.88 MAPK8 (0.32) TGFBR1TGFBR2
SCHEMBL14313250 0.87 HPGDS (0.37) TGFBR1TGFBR2HPGDS
SCHEMBL14312571 0.86 HPGDS (0.40) HPGDS
SCHEMBL14313093 0.86 — —
SCHEMBL14313200 0.86 MAPK8 (0.32) TGFBR1TGFBR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2142516-B1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS SANOFI SA (FR) 2012-12-26 — — EP claimed
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