SCHEMBL2136288

SCHEMBL2136288

C=Cc1ccccc1CC(N)=O

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.36
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CA2 P00918 1/20 0.35
AKR1B1 P15121 1/20 0.35
PLA2G10 O15496 2/20 0.35
SLC9A1 P19634 1/20 0.34
ICMT O60725 1/20 0.33
BCL2A1 Q16548 1/20 0.33
PLA2G2A P14555 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL4443824 0.84 ALDH1A1 (0.40) ALDH1A1AKR1B1LMNA
SCHEMBL2888492 0.82 MEN1 (0.46) ALDH1A1HTTGAANPSR1CA2
SCHEMBL156765 0.82 AKR1B1 (0.55) AKR1B1
SCHEMBL10864725 0.81 L3MBTL1 (0.45) ALDH1A1GAAAKR1B1LMNA
SCHEMBL27976060 0.81 AKR1B1 (0.53) AKR1B1
Lithium SCHEMBL29604103 0.81 AKR1B1 (0.53) AKR1B1
Hydrochloric Acid SCHEMBL10627468 0.81 AKR1B1 (0.53) AKR1B1
SCHEMBL10339218 0.79 AKR1B1 (0.46) ALDH1A1GAANPSR1CA2AKR1B1
SCHEMBL1406137 0.78 ALDH1A1 (0.35) ALDH1A1AKR1B1LMNASMN1; SMN2
Acrylamide SCHEMBL28190425 0.78 ALDH1A1 (0.39) ALDH1A1HTTGAASLC9A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150191607-A1 Anti-fouling Paints and Coatings REACTIVE SURFACES, LTD (US) 2015-07-09 US disclosed
US-20140196631-A1 VISUAL ASSAYS FOR COATINGS INCORPORATING BIOACTIVE ENZYMES FOR CATALYTIC FUNCTIONS REACTIVE SURFACE, LTD. (US) 2014-07-17 US disclosed
US-20120097194-A1 Polymeric Coatings Incorporating Bioactive Enzymes for Catalytic Function REACTIVE SURFACES, LTD. (US) 2012-04-26 US disclosed
US-20110250626-A1 Visual Assays for Coatings Incorporating Bioactive Enzymes for Catalytic Functions REACTIVE SURFACES, LTD. (US) 2011-10-13 US disclosed
US-20110240064-A1 Polymeric Coatings Incorporating Bioactive Enzymes for Cleaning a Surface REACTIVE SURFACES, LTD. (US) 2011-10-06 US disclosed
US-20100210745-A1 Molecular Healing of Polymeric Materials, Coatings, Plastics, Elastomers, Composites, Laminates, Adhesives, and Sealants by Active Enzymes REACTIVE SURFACES, LTD. (US) 2010-08-19 US disclosed
WO-2007018376-A1 PRODUCING METHOD FOR CERIUM-BASED GLASS POLISHING MATERIAL AND METHOD FOR USING THE SAME JOUNG IN (KR) 2007-02-15 WO disclosed