SCHEMBL7991893

SCHEMBL7991893

CCOC(=O)/C(=N\O)C(=O)c1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
SMN1; SMN2 Q16637 2/20 0.48
CES2 O00748 3/20 0.47
CES1 P23141 3/20 0.47
ALDH1A1 P00352 2/20 0.47
GAA P10253 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
ABCB1 P08183 1/20 0.44
SIRT2 Q8IXJ6 1/20 0.42
SIRT1 Q96EB6 1/20 0.42
SIRT3 Q9NTG7 1/20 0.42
CYP19A1 P11511 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
POLB P06746 1/20 0.41
KYAT1 Q16773 1/20 0.41
ABCB11 O95342 1/20 0.41

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
SCHEMBL7991894 1.00 MAPT (0.53) MAPTSMN1; SMN2CES2CES1ALDH1A1
SCHEMBL7991675 0.87 CES2 (0.48) MAPTSMN1; SMN2CES2CES1ALDH1A1
SCHEMBL7991679 0.87 CES2 (0.48) MAPTSMN1; SMN2CES2CES1ALDH1A1
SCHEMBL18017521 0.87 CES2 (0.48) MAPTSMN1; SMN2CES2CES1ALDH1A1
SCHEMBL7978018 0.84 MAPT (0.49) MAPTSMN1; SMN2CES2CES1ALDH1A1
SCHEMBL4372774 0.84 HTT (0.55) MAPTCES2CES1ALDH1A1GAA
SCHEMBL13604742 0.84 HTT (0.55) MAPTCES2CES1ALDH1A1GAA
SCHEMBL4372776 0.84 HTT (0.55) MAPTCES2CES1ALDH1A1GAA
SCHEMBL7978024 0.84 MAPT (0.49) MAPTSMN1; SMN2CES2CES1ALDH1A1
SCHEMBL1968821 0.84 ALDH1A1 (0.61) MAPTSMN1; SMN2CES2CES1ALDH1A1

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-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed