SCHEMBL10905935

SCHEMBL10905935

CCOC(=O)CNC(=O)CC(c1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.51
ALDH1A1 P00352 2/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 2/20 0.46
PPID Q08752 1/20 0.45
TACR1 P25103 1/20 0.44
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
HTT P42858 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ATM Q13315 1/20 0.42

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
SCHEMBL10908122 0.89 GAA (0.47) GAAALDH1A1LMNAPPIDKDM4E
SCHEMBL10908314 0.87 HPGD (0.56) GAAALDH1A1LMNAPPIDTACR1
SCHEMBL10908208 0.84 ALDH1A1 (0.51) GAAALDH1A1LMNACYP3A4CYP2C9
SCHEMBL10909336 0.75 ALDH1A1 (0.50) ALDH1A1LMNATP53TACR1HPGD
SCHEMBL3835577 0.75 MEN1 (0.55) LMNAPPIDKDM4EMAPTMEN1
SCHEMBL10898232 0.75 MEN1 (0.72) GAAALDH1A1TP53KDM4EMAPT
SCHEMBL10950927 0.74 TSHR (0.58) GAAALDH1A1LMNAMAPTMEN1
SCHEMBL3519792 0.74 LMNA (0.50) ALDH1A1LMNACYP3A4CYP2C9CYP2C19
SCHEMBL655874 0.74 POLB (0.58) GAAALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL13572974 0.73 FFAR1 (0.48) GAAALDH1A1LMNACYP3A4HTT

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
US-4603145-A Antiatherosclerotic diphenyl alkanamides AMERICAN CYANAMID COMPANY (US) 1986-07-29 US disclosed