SCHEMBL2810503

SCHEMBL2810503

CC=C(C)C(=O)OC1CC(C)(C)NC(C)(C)C1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.49
MAPT P10636 1/20 0.39
ALDH1A1 P00352 1/20 0.32
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
PKM P14618 1/20 0.31
KDM4E B2RXH2 1/20 0.30
CYP3A4 P08684 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 1/20 0.30
RECQL P46063 1/20 0.30
TSHR P16473 1/20 0.30
EZH2 Q15910 1/20 0.30

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
SCHEMBL4917376 1.00 GAA (0.49) GAAMAPTALDH1A1ATML3MBTL1
SCHEMBL10027504 0.89 GAA (0.49) GAAMAPTALDH1A1ATML3MBTL1
SCHEMBL27782632 0.87 GAA (0.47) GAAMAPTALDH1A1ATML3MBTL1
SCHEMBL134388 0.86 GAA (0.56) GAAMAPTALDH1A1ATML3MBTL1
SCHEMBL28472860 0.85 GAA (0.51) GAAMAPTALDH1A1ATML3MBTL1
SCHEMBL10027482 0.84 GAA (0.45) GAAALDH1A1
SCHEMBL11848144 0.84 GAA (0.47) GAAATML3MBTL1POLBKMT2A
SCHEMBL11588955 0.82 GAA (0.53) GAAMAPTALDH1A1ATML3MBTL1
SCHEMBL107001 0.81 GAA (0.49) GAAALDH1A1ATML3MBTL1POLB
SCHEMBL27461056 0.81 GAA (0.56) GAAATML3MBTL1POLBKMT2A

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
CN-106458883-A Chlorine resistant polyethylene compounds and articles made therefrom 弗纳技术股份有限公司 2017-02-22 CN claimed
CN-110225933-B Aqueous polyurethane resin composition 株式会社艾迪科 2021-11-19 CN disclosed
CN-106458883-A Chlorine resistant polyethylene compounds and articles made therefrom 弗纳技术股份有限公司 2017-02-22 CN disclosed
CN-103140555-B The coating product of anti-flammability coating material aqueous polyurethane resin combination and coating said composition ADEKA CORP. (JP) 2016-06-01 CN disclosed
CN-103649143-B Water-soluble polyurethane resin composition and easily adhesive polyester film coated with same ADEKA CORP. (JP) 2016-04-20 CN disclosed
EP-2210918-B1 RESIN COMPOSITION AND RESIN MOLDED ARTICLE ADEKA CORP (JP) 2015-01-14 EP disclosed
CN-103189408-B Water-based polyurethane resin composition, coating material using said composition, and coated article ADEKA CORP 2015-01-07 CN disclosed
CN-101855301-A Resin composition and resin molded article ADEKA CORP 2010-10-06 CN disclosed
US-20100249289-A1 RESIN COMPOSITION AND RESIN MOLDED ARTICLE ADEKA CORPORATION (JP) 2010-09-30 US disclosed
EP-2210918-A1 RESIN COMPOSITION AND RESIN MOLDED ARTICLE Adeka Corporation (JP) 2010-07-28 EP disclosed
US-20080103282-A1 Aqueous Dispersion Type Polyurethane Composition ADEKA CORPORATION (JP) 2008-05-01 US disclosed