SCHEMBL14312840

SCHEMBL14312840

Cc1nc(-c2cccc(F)c2)ncc1OC(=O)Nn1cc(CC(F)(F)F)c2cnccc21

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 4/20 0.38
▸ DGAT2 Q96PD7 5/20 0.35
▸ GRIN2B Q13224 2/20 0.34
▸ GRIN1 Q05586 1/20 0.34
▸ ELANE P08246 1/20 0.34
▸ CSNK2A2 P19784 1/20 0.33
▸ CSNK2B P67870 1/20 0.33
▸ KCNT1 Q5JUK3 1/20 0.33
▸ CSNK1D P48730 1/20 0.33
▸ WNT3A P56704 1/20 0.33
▸ GABRA5 P31644 1/20 0.32
▸ ROCK2 O75116 1/20 0.31
▸ NTRK1 P04629 1/20 0.31
▸ FGFR3 P22607 1/20 0.31
▸ KDR P35968 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
SCHEMBL14312801 0.89 HPGDS (0.40) HPGDSDGAT2ELANECSNK2A2CSNK2B
SCHEMBL14313171 0.89 HPGDS (0.46) HPGDSDGAT2GRIN2BGRIN1ELANE
SCHEMBL14313267 0.88 HPGDS (0.43) HPGDSELANENTRK1
SCHEMBL14313359 0.86 HPGDS (0.40) HPGDSDGAT2GRIN2BGRIN1CSNK2A2
SCHEMBL14313346 0.85 HPGDS (0.41) HPGDSGRIN2BCSNK1DWNT3A
SCHEMBL14313160 0.85 HPGDS (0.39) HPGDSDGAT2ELANECSNK2A2CSNK2B
SCHEMBL14313343 0.84 HPGDS (0.44) HPGDSDGAT2GRIN2BGRIN1CSNK2A2
SCHEMBL14312736 0.83 PTGER1 (0.31) HPGDS
SCHEMBL14312398 0.83 HPGDS (0.38) HPGDSGRIN2BGRIN1CSNK1D
SCHEMBL14313349 0.83 HPGDS (0.32) 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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