SCHEMBL11382012

SCHEMBL11382012

CCOC(C(C)=O)C(=O)Nc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.54
ALDH1A1 P00352 2/20 0.54
GAA P10253 2/20 0.54
LMNA P02545 1/20 0.54
ATM Q13315 1/20 0.54
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
MME P08473 1/20 0.48
ACE P12821 1/20 0.48
NAPRT Q6XQN6 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TSHR P16473 1/20 0.47
KLK7 P49862 3/20 0.47
RXFP1 Q9HBX9 1/20 0.46
POLB P06746 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.44
HSP90AA1 P07900 1/20 0.44
GPR55 Q9Y2T6 1/20 0.44

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
SCHEMBL11384461 0.83 EPHX1 (0.49) MAPTALDH1A1GAALMNAATM
SCHEMBL587395 0.81 MAPT (0.59) MAPTALDH1A1GAALMNAATM
SCHEMBL25336398 0.80 KLK7 (0.56) MAPTALDH1A1GAALMNAATM
SCHEMBL11380977 0.79 ALDH1A1 (0.56) MAPTALDH1A1GAALMNAATM
SCHEMBL4561508 0.79 POLB (0.56) ALDH1A1GAALMNAMEN1KMT2A
SCHEMBL11089459 0.76 KLK7 (0.52) MAPTALDH1A1GAALMNAATM
SCHEMBL9256009 0.76 HDAC2 (0.54) MAPTALDH1A1GAALMNAATM
SCHEMBL5509053 0.75 ALDH1A1 (0.52) ALDH1A1MEN1KMT2AKLK7
SCHEMBL11394858 0.75 ALDH1A1 (0.59) MAPTALDH1A1GAALMNAATM
SCHEMBL10740441 0.73 TSHR (0.59) MAPTALDH1A1GAALMNAMEN1

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-4305833-A Lubricating oils containing acetoacetanilides as antioxidants UOP INC. (US) 1981-12-15 US disclosed