SCHEMBL1828070

SCHEMBL1828070

NC(=O)c1cnc(F)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NNMT P40261 7/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HPGDS O60760 2/20 0.42
VNN1 O95497 1/20 0.42
PSMD14 O00487 1/20 0.40
STAMBP O95630 1/20 0.40
COPS5 Q92905 1/20 0.40
BACE1 P56817 1/20 0.40
PARP1 P09874 1/20 0.39
CYP11B2 P19099 1/20 0.39
LMNA P02545 1/20 0.38
KDM4E B2RXH2 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
CHRNB2 P17787 1/20 0.36
CHRNA4 P43681 1/20 0.36

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
SCHEMBL30445761 1.00 NNMT (0.44) NNMTSMN1; SMN2HPGDSVNN1PSMD14
SCHEMBL23203545 0.82 NNMT (0.47) NNMTSMN1; SMN2HPGDSVNN1PSMD14
SCHEMBL898595 0.81 HCAR2 (0.50) SMN1; SMN2VNN1PSMD14LMNAKDM4E
SCHEMBL30721127 0.81 HCAR2 (0.50) SMN1; SMN2VNN1PSMD14LMNAKDM4E
SCHEMBL26337535 0.80 LMNA (0.42) NNMTSMN1; SMN2HPGDSVNN1PSMD14
SCHEMBL13465582 0.80 LMNA (0.42) NNMTSMN1; SMN2HPGDSPSMD14STAMBP
SCHEMBL28817028 0.79 BACE1 (0.40) BACE1LMNA
SCHEMBL12350329 0.79 NNMT (0.40) NNMTSMN1; SMN2HPGDSVNN1PSMD14
SCHEMBL31575526 0.77 VNN1 (0.40) NNMTSMN1; SMN2HPGDSVNN1PSMD14
SCHEMBL13394495 0.76 NNMT (0.39) NNMTSMN1; SMN2HPGDSPSMD14STAMBP

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2318416-A1 SPIROAMINODIHYDROTHIAZINE DERIVATIVES Eisai R&D Management Co., Ltd. (JP) 2011-05-11 EP disclosed
WO-2010013794-A1 SPIROAMINODIHYDROTHIAZINE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-02-04 WO disclosed
EP-1246802-A1 4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES Dow Agrosciences LLC (US) 2002-10-09 EP disclosed
WO-2001051468-A1 4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2001-07-19 WO disclosed