SCHEMBL4631652

SCHEMBL4631652

C=CCN(C=C)Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
ALDH1A1 P00352 2/20 0.41
TSHR P16473 1/20 0.41
PYCR1 P32322 1/20 0.39
AOC3 Q16853 1/20 0.39
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
CA12 O43570 2/20 0.37
CA9 Q16790 2/20 0.37
G6PC1 P35575 1/20 0.37
BCHE P06276 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL266738 0.87 ALDH1A1 (0.48) GAAALDH1A1TSHRAOC3L3MBTL1
Hydrochloric Acid SCHEMBL3922809 0.85 ALDH1A1 (0.46) GAAALDH1A1TSHRAOC3GRIN2D
SCHEMBL4634377 0.84 GAA (0.41) GAAALDH1A1TSHRPYCR1AOC3
SCHEMBL9698782 0.84 GAA (0.41) GAAALDH1A1TSHRPYCR1AOC3
SCHEMBL7741256 0.81 ALDH1A1 (0.43) GAAALDH1A1TSHRAOC3L3MBTL1
Hydrochloric Acid SCHEMBL7572937 0.80 ALDH1A1 (0.39) GAAALDH1A1TSHRAOC3L3MBTL1
SCHEMBL8415458 0.79 TSHR (0.48) GAAALDH1A1TSHRAOC3MGLL
Hydrochloric Acid SCHEMBL11773955 0.79 OPRM1 (0.45) GAAAOC3BCHE
SCHEMBL2688603 0.78 BCHE (0.49) GAAALDH1A1TSHRPYCR1AOC3
SCHEMBL516674 0.78 BCHE (0.49) GAAALDH1A1TSHRPYCR1AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4479879-A CATIONIC POLYMER FLOCCULANTS, ANIONIC POLYMER FLOCCULANTS KURITA WATER INDUSTRIES LTD. (JP) 1984-10-30 US claimed
JP-55049150-A None JP disclosed
EP-1927889-A1 Lithographic printing plate precursor FUJIFILM Corporation (JP) 2008-06-04 EP disclosed
US-6558873-B1 Interlayer containing a compound capable of forming a complex with aluminum and a photopolymerizable photosensitive layer containing a photopolymerization initiator, an addition polymerizable compound capable of complexing with aluminum FUJI PHOTO FILM CO., LTD. (JP) 2003-05-06 US disclosed
EP-1091251-A2 Lithographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 2001-04-11 EP disclosed
US-5009880-A Mixture of an anionic and cationic polymer for shampoos, skin lotions, nail strengtheners and hair dyeing; improved fixing and anchoring; smoothness; gloss L'OREAL (FR) 1991-04-23 US disclosed
US-4715691-A Electrochromic display using bipolar ion-exchange membrane TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1987-12-29 US disclosed
US-4479879-A CATIONIC POLYMER FLOCCULANTS, ANIONIC POLYMER FLOCCULANTS KURITA WATER INDUSTRIES LTD. (JP) 1984-10-30 US disclosed
US-4445521-A ANIONIC AND CATIONIC POLYMER COMBINATION L'OREAL (FR) 1984-05-01 US disclosed
US-4240450-A HAIR CONDITIONER OF ANIONIC POLYMERS AND CATIONIC POLYMERS L'OREAL (FR) 1980-12-23 US disclosed
JP-S5549150-A PRODUCTION OF HEAT REGENERATING ION EXCHANGE RESIN MITSUBISHI CHEM IND LTD 1980-04-09 JP disclosed