SCHEMBL4741896

SCHEMBL4741896

CC(C)(C)OC(=O)N(c1ccc(C(F)(F)F)cc1)c1ccccc1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 10/20 0.40
PTPRA P18433 1/20 0.40
TAS2R14 Q9NYV8 1/20 0.38
ENPP2 Q13822 1/20 0.37
TRPA1 O75762 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
CYP2C19 P33261 1/20 0.36
HSD17B10 Q99714 1/20 0.36
LTC4S Q16873 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
PPARG P37231 2/20 0.36
PPARA Q07869 2/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL5339338 0.85 ATM (0.44) ALDH1A1
SCHEMBL1465488 0.78 SRD5A2 (0.45) TAS2R14TRPA1TRPM8KDM4EALDH1A1
SCHEMBL272401 0.74 KIF11 (0.40) ALDH1A1
SCHEMBL28610571 0.73 LMNA (0.41) KDM4EALDH1A1SMN1; SMN2
SCHEMBL504005 0.73 L3MBTL1 (0.55) ALDH1A1CYP2C19HSD17B10SMN1; SMN2
SCHEMBL1690946 0.73 ALDH1A1 (0.39) PTPN1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL29837166 0.73 MT-CO2 (0.41) PTPN1PTPRA
SCHEMBL21000444 0.73 GSK3B (0.41) TRPM8CYP2C19SMN1; SMN2
SCHEMBL7667615 0.72 LMNA (0.49) SMN1; SMN2
SCHEMBL5058365 0.72 PTGIR (0.50) KDM4E

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
WO-2008090357-A2 N, N; -SUBSTITUTED PIPERAZINES BINDING TO MELANOCORTIN RECEPTOR PALATIN TECHNOLOGIES, INC. (US) 2008-07-31 WO disclosed