SCHEMBL14313154

SCHEMBL14313154

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

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 1/20 0.31
▸ TGFBR1 P36897 5/20 0.31
▸ TGFBR2 P37173 3/20 0.31
▸ MAPK8 P45983 1/20 0.30
▸ MAPK9 P45984 1/20 0.30
▸ MAPK10 P53779 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
SCHEMBL14313200 0.93 MAPK8 (0.32) TGFBR1TGFBR2MAPK8MAPK9MAPK10
SCHEMBL14312676 0.93 TGFBR1 (0.32) TGFBR1TGFBR2
SCHEMBL14312784 0.93 NTRK1 (0.31) NTRK1
SCHEMBL14313194 0.90 HPGDS (0.36) TGFBR1TGFBR2MAPK8MAPK9MAPK10
SCHEMBL14312961 0.89 AGTR2 (0.30) NTRK1
SCHEMBL14312836 0.86 TGFBR1 (0.32) TGFBR1TGFBR2MAPK8MAPK9MAPK10
SCHEMBL14313250 0.86 HPGDS (0.37) NTRK1TGFBR1TGFBR2
SCHEMBL14312827 0.86 PTGER1 (0.30) —
SCHEMBL14312622 0.85 MAPK8 (0.32) TGFBR1TGFBR2MAPK8MAPK9MAPK10
SCHEMBL14313407 0.85 HPGDS (0.30) —

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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