SCHEMBL14312866

SCHEMBL14312866

Cc1csc(-c2ncc(OC(=O)Nn3cc(CC(F)(F)F)c4ccncc43)c(C)n2)n1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 1/20 0.34
▸ MAPK9 P45984 1/20 0.34
▸ MAPK10 P53779 1/20 0.34
▸ TGFBR1 P36897 3/20 0.31
▸ TGFBR2 P37173 2/20 0.31
▸ PTGER1 P34995 1/20 0.30
▸ MAPT P10636 2/20 0.30
▸ NPSR1 Q6W5P4 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
SCHEMBL14313051 0.93 PTGER1 (0.33) PTGER1
SCHEMBL14313212 0.90 MAPK8 (0.33) MAPK8MAPK9MAPK10TGFBR1TGFBR2
SCHEMBL14313030 0.90 MAPK8 (0.33) MAPK8MAPK9MAPK10
SCHEMBL14312847 0.90 HPGDS (0.36) MAPK8MAPK9MAPK10TGFBR1TGFBR2
SCHEMBL14312949 0.88 HPGDS (0.34) MAPK8MAPK9MAPK10TGFBR1TGFBR2
SCHEMBL14312963 0.87 HPGDS (0.41) —
SCHEMBL14312736 0.87 PTGER1 (0.31) PTGER1
SCHEMBL14313324 0.87 TGFBR1 (0.34) TGFBR1MAPTNPSR1
SCHEMBL14312836 0.85 TGFBR1 (0.32) MAPK8MAPK9MAPK10TGFBR1TGFBR2
SCHEMBL14313200 0.85 MAPK8 (0.32) MAPK8MAPK9MAPK10TGFBR1TGFBR2

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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