SCHEMBL9244683

SCHEMBL9244683

NC(=O)/C=C\C(=O)Nc1ccc(I)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.69
▸ MAPT P10636 7/20 0.69
▸ HTT P42858 3/20 0.69
▸ DDAH1 O94760 1/20 0.69
▸ LPAR2 Q9HBW0 1/20 0.50
▸ LPAR3 Q9UBY5 1/20 0.50
▸ LMNA P02545 2/20 0.49
▸ PKM P14618 1/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ GAA P10253 2/20 0.49
▸ TDP2 O95551 1/20 0.49
▸ THRB P10828 1/20 0.49
▸ NMT1 P30419 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ CA12 O43570 1/20 0.45
▸ CA1 P00915 1/20 0.45
▸ CA2 P00918 1/20 0.45
▸ CA9 Q16790 1/20 0.45

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
SCHEMBL2429556 0.90 ALDH1A1 (0.81) ALDH1A1MAPTHTTDDAH1LPAR2
SCHEMBL8733897 0.83 MAPT (0.71) ALDH1A1MAPTHTTDDAH1LPAR2
SCHEMBL7771122 0.83 MAPT (0.71) ALDH1A1MAPTHTTDDAH1LPAR2
SCHEMBL5177391 0.81 DDAH1 (1.00) ALDH1A1MAPTHTTDDAH1LPAR2
SCHEMBL5177465 0.81 DDAH1 (1.00) ALDH1A1MAPTHTTDDAH1LPAR2
SCHEMBL15708801 0.81 ALDH1A1 (0.69) ALDH1A1MAPTHTTDDAH1LPAR2
SCHEMBL2682631 0.81 MAPT (0.68) ALDH1A1MAPTHTTDDAH1LPAR2
SCHEMBL5176397 0.81 MAPT (0.68) ALDH1A1MAPTHTTDDAH1LPAR2
SCHEMBL2682630 0.81 MAPT (0.68) ALDH1A1MAPTHTTDDAH1LPAR2
SCHEMBL5481885 0.77 MAPT (0.63) ALDH1A1MAPTHTTDDAH1LMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5446106-A Additional polymerizing a maleic anhydride with a dioxolane in presence of a free radical catalysts, futher reacting with primary amine EASTMAN CHEMICAL COMPANY (US) 1995-08-29 — — US disclosed
US-5418294-A Clear films EASTMAN CHEMICAL COMPANY (US) 1995-05-23 — — US disclosed
WO-1994015976-A1 COPOLYMERS OF VINYL DIOXOLANES AND IMIDIZED DERIVATIVES OF MALEIC ANHYDRIDE EASTMAN CHEMICAL COMPANY (US) 1994-07-21 — — WO disclosed
US-5304611-A Can be cast as clear films or used as crosslinking agents EASTMAN KODAK COMPANY (US) 1994-04-19 — — US disclosed
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