SCHEMBL14313158

SCHEMBL14313158

Cc1nc(-c2nc(Cl)cs2)ncc1OC(=O)Nn1cc(CC(F)(F)F)c2cccnc21

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 1/20 0.31
▸ CES2 O00748 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
SCHEMBL14313324 0.93 TGFBR1 (0.34) HPGDSCES2
SCHEMBL14312554 0.89 CES2 (0.30) CES2
SCHEMBL14312794 0.89 HPGDS (0.31) HPGDSCES2
SCHEMBL14312939 0.88 HPGDS (0.34) HPGDS
SCHEMBL14312748 0.88 HPGDS (0.37) HPGDS
SCHEMBL14312910 0.88 HPGDS (0.40) HPGDSCES2
SCHEMBL14312613 0.87 HPGDS (0.34) HPGDS
SCHEMBL14313051 0.87 PTGER1 (0.33) —
SCHEMBL14312736 0.87 PTGER1 (0.31) HPGDS
SCHEMBL14313173 0.84 PDE4A (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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