SCHEMBL7991675

SCHEMBL7991675

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.48
CES1 P23141 4/20 0.48
ALDH1A1 P00352 4/20 0.45
MAPT P10636 3/20 0.45
GAA P10253 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HTT P42858 1/20 0.44
DHODH Q02127 1/20 0.43
KMT2A Q03164 2/20 0.41
RAB9A P51151 3/20 0.40
LMNA P02545 2/20 0.40
KDM4E B2RXH2 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
POLB P06746 1/20 0.40
ACHE P22303 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
ESR1 P03372 1/20 0.40
CA7 P43166 1/20 0.40

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
SCHEMBL18017521 1.00 CES2 (0.48) CES2CES1ALDH1A1MAPTGAA
SCHEMBL7991679 1.00 CES2 (0.48) CES2CES1ALDH1A1MAPTGAA
SCHEMBL13604742 0.87 HTT (0.55) CES2CES1ALDH1A1MAPTGAA
SCHEMBL7991894 0.87 MAPT (0.53) CES2CES1ALDH1A1MAPTGAA
SCHEMBL4372776 0.87 HTT (0.55) CES2CES1ALDH1A1MAPTGAA
SCHEMBL4372774 0.87 HTT (0.55) CES2CES1ALDH1A1MAPTGAA
SCHEMBL7991893 0.87 MAPT (0.53) CES2CES1ALDH1A1MAPTGAA
SCHEMBL7978018 0.87 MAPT (0.49) CES2CES1ALDH1A1MAPTGAA
SCHEMBL7978024 0.87 MAPT (0.49) CES2CES1ALDH1A1MAPTGAA
SCHEMBL19663921 0.87 ALDH1A1 (0.61) CES2CES1ALDH1A1MAPTSMN1; SMN2

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