SCHEMBL4892555

SCHEMBL4892555

CCCCOCOC(=O)C=CC#N

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.52
HCAR2 Q8TDS4 5/20 0.46
ZDHHC20 Q5W0Z9 3/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41
TSHR P16473 2/20 0.41
HPGD P15428 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 1/20 0.37
APP P05067 2/20 0.35
CES2 O00748 1/20 0.33
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL4889833 0.90 HCAR2 (0.43) ATMHCAR2ZDHHC20ZDHHC2TSHR
SCHEMBL35576 0.87 ATM (0.56) ATMHCAR2ZDHHC20ZDHHC2TSHR
SCHEMBL4888251 0.87 ATM (0.61) ATMHCAR2ZDHHC20ZDHHC2TSHR
SCHEMBL4889702 0.87 ATM (0.56) ATMHCAR2ZDHHC20ZDHHC2TSHR
SCHEMBL4892532 0.87 ATM (0.61) ATMHCAR2ZDHHC20ZDHHC2TSHR
SCHEMBL24797 0.86 ATM (0.70) ATMHCAR2ZDHHC20ZDHHC2TSHR
SCHEMBL828236 0.82 HCAR2 (0.39) ATMHCAR2ZDHHC20ZDHHC2TSHR
SCHEMBL4891840 0.82 HCAR2 (0.51) ATMHCAR2ZDHHC20ZDHHC2TSHR
SCHEMBL19579380 0.81 ATM (0.63) ATMHCAR2ZDHHC20ZDHHC2TSHR
SCHEMBL6465406 0.81 ATM (0.63) ATMHCAR2ZDHHC20ZDHHC2TSHR

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
CN-113874459-A Flexible photocurable cyanoacrylate compositions 汉高知识产权控股有限责任公司 2021-12-31 CN disclosed
CN-105246872-A Cyanoacrylate compositions Henkel US IP LLC 2016-01-13 CN disclosed
US-20080293872-A1 ADHESIVES, SEALANTS AND COATINGS CONTAINING GLASS PARTICLES AS A FILLER HENKEL AG & CO. KGAA (DE) 2008-11-27 US disclosed
US-20080287574-A1 ADHESIVES, SEALANTS AND COATINGS CONTAINING GLASS PARTICLES AS A FILLER HENKEL AG & CO. KGAA (DE) 2008-11-20 US disclosed