SCHEMBL11312851

SCHEMBL11312851

O=C(/C=C/c1ccc(Cl)cc1)OCC#CI

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ USP2 O75604 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ CYP1A2 P05177 1/20 0.49
▸ MAPT P10636 2/20 0.47
▸ ATM Q13315 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.44
▸ NPY1R P25929 1/20 0.44
▸ NPY2R P49146 1/20 0.44
▸ CA12 O43570 1/20 0.44
▸ CA1 P00915 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ CA7 P43166 1/20 0.44
▸ CA9 Q16790 1/20 0.44
▸ CA14 Q9ULX7 1/20 0.44
▸ GAA P10253 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ NOS3 P29474 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
SCHEMBL11312847 1.00 LMNA (0.50) LMNAKMT2AUSP2MEN1CYP1A2
SCHEMBL11311432 0.85 CA12 (0.51) LMNAKMT2AMAPTL3MBTL1KDM4E
SCHEMBL11309627 0.85 LMNA (0.58) LMNAKMT2AMEN1CYP1A2MAPT
SCHEMBL11309624 0.85 LMNA (0.58) LMNAKMT2AMEN1CYP1A2MAPT
SCHEMBL11311651 0.83 LMNA (0.58) LMNAKMT2AMEN1MAPTATM
SCHEMBL11311620 0.83 LMNA (0.58) LMNAKMT2AMEN1MAPTATM
Ethyl 3-(4-Chlorophenyl)Acrylate SCHEMBL14415942 0.76 CA12 (0.73) LMNAKMT2AUSP2MEN1CYP1A2
Ethyl 3-(4-Chlorophenyl)Acrylate SCHEMBL660637 0.76 CA12 (0.73) LMNAKMT2AUSP2MEN1CYP1A2
Ethyl 3-(4-Chlorophenyl)Acrylate SCHEMBL321285 0.76 CA12 (0.73) LMNAKMT2AUSP2MEN1CYP1A2
SCHEMBL22596717 0.75 LMNA (0.62) LMNAKMT2AUSP2MEN1CYP1A2

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-4259350-A PROTECTING DEGRADABLE ORGANIC MATERIAL FROM FUNGAL OR INSECT ATTACK SANKYO COMPANY LIMITED (JP) 1981-03-31 — — US disclosed
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