SCHEMBL7150928

SCHEMBL7150928

CC(C)C[C@H]1C(=O)N(Cc2ccc3c(N)ncnc3c2)CCN1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 13/20 0.47
ELANE P08246 1/20 0.38
DHFR P00374 1/20 0.35
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35
PGGT1B P53609 1/20 0.35
DGAT1 O75907 1/20 0.34
NR1I2 O75469 1/20 0.33
GRM2 Q14416 1/20 0.33
MAP4K4 O95819 1/20 0.33

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
SCHEMBL7150921 1.00 F10 (0.47) F10ELANEDHFRFNTAFNTB
SCHEMBL4389189 0.90 F10 (0.47) F10DGAT1NR1I2GRM2
SCHEMBL7145836 0.89 F10 (0.48) F10DGAT1NR1I2GRM2
SCHEMBL7145840 0.89 F10 (0.48) F10DGAT1NR1I2GRM2
SCHEMBL4388077 0.88 F10 (0.46) F10DGAT1NR1I2GRM2
SCHEMBL4388083 0.88 F10 (0.46) F10DGAT1NR1I2GRM2
SCHEMBL1384927 0.87 F10 (0.46) F10DGAT1GRM2
SCHEMBL1651383 0.87 F10 (0.46) F10DGAT1GRM2
SCHEMBL7144367 0.87 F10 (0.47) F10DGAT1GRM2
SCHEMBL7144382 0.87 F10 (0.47) F10DGAT1GRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2003508353-A 2003-03-04 JP claimed
EP-1208097-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS Aventis Pharmaceuticals Inc. (US) 2002-05-29 EP claimed
WO-2001007436-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 2001-02-01 WO claimed