SCHEMBL221941

SCHEMBL221941

CC(C)c1cc(-c2cc(C(C)C)c(N=C=O)c(C(C)C)c2)cc(C(C)C)c1N=C=O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
GABRA1 P14867 2/20 0.36
GABRB2 P47870 1/20 0.36
CYP3A4 P08684 3/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GABRB1 P18505 1/20 0.31
TRPA1 O75762 1/20 0.31

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
SCHEMBL7167416 0.89 GABRA1 (0.38) CA1CA2GABRA1GABRB2CYP3A4
SCHEMBL16779903 0.85 GABRA1 (0.35) GABRA1GABRB2CYP3A4GABRB1TRPA1
SCHEMBL3675026 0.85 FABP4 (0.44) GABRA1GABRB2ALDH1A1GABRB1
SCHEMBL661595 0.85 CYP3A4 (0.37) GABRA1GABRB2CYP3A4ALDH1A1TDP1
SCHEMBL7145360 0.85 GABRA1 (0.48) GABRA1GABRB2GABRB1
SCHEMBL7144769 0.83 DRD2 (0.36) CA1CA2
SCHEMBL20635011 0.83 GABRA1 (0.34) GABRA1GABRB2
SCHEMBL6866102 0.83 GABRA1 (0.47) GABRA1GABRB2TDP1GABRB1
SCHEMBL403988 0.82 CYP3A4 (0.39) GABRA1GABRB2CYP3A4
SCHEMBL24891310 0.81 CYP3A4 (0.38) GABRA1GABRB2CYP3A4TDP1GABRB1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8178628-B2 Aliphatic polyester resin composition and method for production thereof NEC CORPORATION (JP) 2012-05-15 US claimed
EP-4303267-A1 THERMOPLASTIC POLYESTER ELASTOMER COMPOSITION, PREPARATION METHOD THEREFOR AND MOLDED ARTICLE COMPRISING SAME LG CHEM, LTD. (KR) 2024-01-10 EP disclosed
US-20220204754-A1 POLYESTER RESIN COMPOSITION, POLYESTER-BASED INJECTION-MOLDED ARTICLE, POLYESTER-BASED EXTRUDED ARTICLE, POLYESTER-BASED FOAM, POLYESTER-BASED CONTAINER, POLYESTER-BASED BOTTLE, POLYESTER-BASED TABLEWARE, AND POLYESTER-BASED NURSING BOTTLE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2022-06-30 US disclosed
US-10961388-B2 Polylactic acid resin composition and polyester resin composition, and method for producing the same and molded body thereof NEC CORPORATION (JP) 2021-03-30 US disclosed
WO-2020218324-A1 POLYESTER RESIN COMPOSITION, POLYESTER INJECTION-MOLDED ARTICLE, POLYESTER EXTRUSION-MOLDED ARTICLE, POLYESTER FOAM, POLYESTER CONTAINER, POLYESTER BOTTLE, POLYESTER TABLEWARE, AND POLYESTER FEEDING BOTTLE 三菱瓦斯化学株式会社 2020-10-29 WO disclosed
US-20200263028-A1 POLYLACTIC ACID RESIN COMPOSITION AND POLYESTER RESIN COMPOSITION, AND METHOD FOR PRODUCING THE SAME AND MOLDED BODY THEREOF NEC CORPORATION (JP) 2020-08-20 US disclosed
EP-3385329-B1 POLYLACTIC ACID RESIN COMPOSITION AND POLYESTER RESIN COMPOSITION, AND METHODS FOR PRODUCING SAME AND MOLDED ARTICLES THEREOF NEC CORP (JP) 2020-07-29 EP disclosed
US-20180346713-A1 POLYLACTIC ACID RESIN COMPOSITION, AND PRODUCTION METHOD AND MOLDED BODY THEREOF NEC CORPORATION (JP) 2018-12-06 US disclosed
EP-3385329-A1 POLYLACTIC ACID RESIN COMPOSITION AND POLYESTER RESIN COMPOSITION, AND METHODS FOR PRODUCING SAME AND MOLDED ARTICLES THEREOF Nec Corporation (JP) 2018-10-10 EP disclosed
US-20180282516-A1 RESIN ADDITIVE, AND MASTER BATCH AND RESIN COMPOSITION IN WHICH SAME IS USED NISSHINBO CHEMICAL INC. (JP) 2018-10-04 US disclosed
US-20150353725-A1 METHOD FOR PRODUCING POLYESTER RESIN COMPOSITION NISSHINBO CHEMICAL INC. (JP) 2015-12-10 US disclosed
EP-2947119-A1 POLYESTER RESIN COMPOSITION Nisshinbo Chemical Inc. (JP) 2015-11-25 EP disclosed
EP-2947120-A1 METHOD FOR PRODUCING POLYESTER RESIN COMPOSITION Nisshinbo Chemical Inc. (JP) 2015-11-25 EP disclosed
US-20140243875-A1 MEDICAL BALLOON HAVING IMPROVED STABILITY AND STRENGTH BOSTON SCIENTIFIC SCIMED, INC. (US) 2014-08-28 US disclosed
US-8178628-B2 Aliphatic polyester resin composition and method for production thereof NEC CORPORATION (JP) 2012-05-15 US disclosed
US-20120071823-A1 MEDICAL BALLOON HAVING IMPROVED STABILITY AND STRENGTH BOSTON SCIENTIFIC SCIMED, INC. (US) 2012-03-22 US disclosed
EP-2401752-A1 TRANSFORMER OIL COMPOSITION, COMPRISING AT LEAST ONE ACID INTERCEPTOR Rhein Chemie Rheinau GmbH (DE) 2012-01-04 EP disclosed
WO-2010097358-A1 TRANSFORMER OIL COMPOSITION, COMPRISING AT LEAST ONE ACID INTERCEPTOR RHEIN CHEMIE RHEINAU GMBH (DE) 2010-09-02 WO disclosed
US-20090318628-A1 ALIPHATIC POLYESTER RESIN COMPOSITION AND METHOD FOR PRODUCTION THEREOF NEC CORPORATION (JP) 2009-12-24 US disclosed
US-20090137748-A1 POLYLACTIC ACID-MODIFIED POLYCARBODIIMIDE COMPOUND AND POLYLACTIC ACID RESIN COMPOSITION AND MOLDED ARTICLE COMPRISING THE SAME NEC CORPORATION (JP) 2009-05-28 US disclosed