SCHEMBL14312739

SCHEMBL14312739

Cc1nc(-c2nc(Cl)cs2)ncc1OC(=O)Nn1ccc2ccncc21

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SLC22A12 Q96S37 1/20 0.33
▸ MAPT P10636 2/20 0.32
▸ HPGDS O60760 1/20 0.31
▸ TGFBR1 P36897 1/20 0.31
▸ TGFBR2 P37173 1/20 0.31
▸ CYP19A1 P11511 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
SCHEMBL14313107 0.93 SLC22A12 (0.33) SLC22A12HPGDSTGFBR1TGFBR2
SCHEMBL14313355 0.92 TGFBR1 (0.35) SLC22A12MAPTHPGDSTGFBR1TGFBR2
SCHEMBL14313271 0.87 MAPT (0.33) SLC22A12MAPTHPGDS
SCHEMBL14312659 0.86 HPGDS (0.34) HPGDS
SCHEMBL3230591 0.85 HPGDS (0.45) SLC22A12MAPTHPGDSTGFBR1TGFBR2
SCHEMBL14313094 0.84 TGFBR1 (0.35) SLC22A12MAPTHPGDSTGFBR1TGFBR2
SCHEMBL14313345 0.84 HPGDS (0.35) HPGDS
SCHEMBL14313192 0.84 SLC22A12 (0.34) SLC22A12HPGDS
SCHEMBL14312827 0.83 PTGER1 (0.30) —
SCHEMBL14313038 0.83 HPGDS (0.35) HPGDS

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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