SCHEMBL9711482

SCHEMBL9711482

CC1(C)CC(=O)C(C(=O)c2ccc(C(F)(F)F)cc2C(F)(F)F)C(=O)N1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.46
HPD P32754 1/20 0.41
BACE1 P56817 1/20 0.36
SLC6A9 P48067 3/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
HSD17B10 Q99714 2/20 0.34
USP2 O75604 1/20 0.34
CYP2C19 P33261 1/20 0.34
FLT1 P17948 1/20 0.34
FLT4 P35916 1/20 0.34
KDR P35968 1/20 0.34
CRBN Q96SW2 1/20 0.34
SCN4A P35499 1/20 0.33
SCN9A Q15858 1/20 0.33
SCN8A Q9UQD0 1/20 0.33
SCN10A Q9Y5Y9 1/20 0.33
PSMB11 A5LHX3 1/20 0.33
PSMA7 O14818 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
SCHEMBL9711566 0.88 KMT2A (0.38) CRBNPGRAR
SCHEMBL9711790 0.84 HPD (0.64) HPDKDM4EALDH1A1CYP2C19FLT1
SCHEMBL9711606 0.79 BACE1 (0.39) CES2BACE1USP2CYP2C19CRBN
SCHEMBL9711573 0.78 CES2 (0.50) CES2HPDSLC6A9KDM4EALDH1A1
SCHEMBL9711463 0.73 HPD (0.62) HPDKDM4EALDH1A1CYP2C19FLT1
SCHEMBL19295226 0.73 HPD (0.49) CES2HPDBACE1SLC6A9KDM4E
SCHEMBL9711752 0.72 CES2 (0.43) CES2HPDSLC6A9KDM4EALDH1A1
SCHEMBL9711794 0.72 HPD (0.60) HPDKDM4EALDH1A1CYP2C19FLT1
SCHEMBL9711670 0.71 HTT (0.31)
SCHEMBL19283612 0.71 HPD (0.47) CES2HPDBACE1SLC6A9KDM4E

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
EP-0170164-B1 SILVER HALIDE COLOR PHOTOGRAPHIC LIGHT-SENSITIVE MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 1988-10-05 EP claimed
US-5114461-A Herbicides MAY & BAKER LIMITED (GB) 1992-05-19 US disclosed
EP-0278742-A2 Cyclic diones MAY & BAKER LIMITED (GB) 1988-08-17 EP disclosed