SCHEMBL1840252

SCHEMBL1840252

CCCCOC1=NCCCO1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
NOS2 P35228 1/20 0.35
CYP1A2 P05177 5/20 0.35
CYP19A1 P11511 4/20 0.35
CYP2C9 P11712 4/20 0.35
CYP2C19 P33261 4/20 0.35
CYP2D6 P10635 4/20 0.35
MAPK1 P28482 2/20 0.35
KCNH2 Q12809 2/20 0.35
HRH3 Q9Y5N1 2/20 0.35
ALDH1A1 P00352 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
HTR2A P28223 1/20 0.35
SCN1A P35498 1/20 0.35
HTR2B P41595 1/20 0.35
SCN2A Q99250 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
SCN3A Q9NY46 1/20 0.35

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
SCHEMBL1843977 0.95 NOS3 (0.34) NOS3NOS1NOS2CYP1A2CYP19A1
SCHEMBL1842651 0.93 LTA4H (0.36) NOS3NOS1NOS2ALDH1A1LTA4H
SCHEMBL1842065 0.93 LTA4H (0.36) NOS3NOS1NOS2ALDH1A1LTA4H
SCHEMBL1842643 0.93 LTA4H (0.36) NOS3NOS1NOS2ALDH1A1LTA4H
SCHEMBL1843307 0.93 LTA4H (0.36) NOS3NOS1NOS2ALDH1A1LTA4H
SCHEMBL1840461 0.93 LTA4H (0.36) NOS3NOS1NOS2ALDH1A1LTA4H
SCHEMBL961006 0.89 CYP1A2 (0.37) CYP1A2CYP19A1CYP2C9CYP2C19CYP2D6
SCHEMBL1843441 0.89 NOS3 (0.38) NOS3NOS1NOS2
SCHEMBL963957 0.84 MEN1 (0.35) CYP1A2CYP19A1CYP2C9CYP2C19CYP2D6
SCHEMBL961375 0.82 TDP1 (0.37) ALDH1A1LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114174427-B Flame retardant polybutylene terephthalate resin composition 宝理塑料株式会社 2023-08-15 CN disclosed
CN-114174427-A Flame-retardant polybutylene terephthalate resin composition 宝理塑料株式会社 2022-03-11 CN disclosed
WO-2021140565-A1 FLAME-RETARDANT POLYBUTYLENE TEREPHTHALATE RESIN COMPOSITION ポリプラスチックス株式会社 2021-07-15 WO disclosed
WO-2021020095-A1 FLAME-RETARDANT POLY(BUTYLENE TEREPHTHALATE) RESIN COMPOSITION ポリプラスチックス株式会社 2021-02-04 WO disclosed
EP-2213703-B1 AROMATIC POLYCARBONATE RESIN COMPOSITION TEIJIN LTD (JP) 2018-05-16 EP disclosed
US-9650350-B2 Polylactic acid composition TEIJIN LIMITED (JP) 2017-05-16 US disclosed
EP-2450388-B1 POLYLACTIC ACID RESIN, METHOD FOR PRODUCING POLYLACTIC ACID RESIN, POLYLACTIC ACID RESIN COMPOSITION, STEREOCOMPLEX POLYLACTIC ACID RESIN COMPOSITION, AND METHOD FOR PRODUCING STEREOCOMPLEX POLYLACTIC ACID RESIN COMPOSITION MITSUI CHEMICALS INC (JP) 2017-01-11 EP disclosed
EP-2527400-B1 POLYLACTIC ACID COMPOSITION TEIJIN LTD (JP) 2016-03-30 EP disclosed
EP-1983030-B1 RESIN COMPOSITION, MOLDED ARTICLE AND THEIR PRODUCTION METHODS TEIJIN CHEMICALS LTD (JP) 2014-10-15 EP disclosed
CN-104017153-A Polylactic acid resin composition MITSUI CHEMICALS INC 2014-09-03 CN disclosed
US-7268190-B2 Resin composition comprising polylactic acid and polyacetal and a molded article, film, and fiber each comprising the same TORAY INDUSTRIES, INC. (JP) 2007-09-11 US disclosed
EP-1792941-A1 RESIN COMPOSITION AND MOLDED ARTICLE COMPRISING THE SAME TORAY INDUSTRIES, INC. (JP) 2007-06-06 EP disclosed
US-20060276617-A1 Aliphatic polyester resin composition, preparation method therefor, and molded article and foamed article produced from the resin composition UNITIKA LTD. (JP) 2006-12-07 US disclosed
CN-1805999-A Aliphatic polyester resin composition, method for production thereof, molded article and foamed article comprising the resin composition UNITIKA LTD (JP) 2006-07-19 CN disclosed
EP-1640406-A1 ALIPHATIC POLYESTER RESIN COMPOSITION, METHOD FOR PRODUCTION THEREOF, MOLDED ARTICLE AND FOAMED ARTICLE COMPRISING THE RESIN COMPOSITION UNITIKA LTD. (JP) 2006-03-29 EP disclosed
US-20040242803-A1 Resin composition and molded article, film, and fiber each comprising the same TORAY INDUSTRIES, INC. (JP) 2004-12-02 US disclosed
EP-1445282-A1 RESIN COMPOSITION AND MOLDED ARTICLE FILM AND FIBER EACH COMPRISING THE SAME TORAY INDUSTRIES, INC. (JP) 2004-08-11 EP disclosed
EP-0030350-B1 METHOD FOR REDUCING THE TERMINAL CARBOXYL GROUP CONTENT OF A SATURATED POLYESTER, A SATURATED POLYESTER HAVING A REDUCED TERMINAL CARBOXYL GROUP CONTENT, AND A MOLDED ARTICLE COMPOSED OF SUCH A SATURATED POLYESTER TEIJIN LIMITED (JP) 1984-10-10 EP disclosed
US-4351936-A COMPRISING ENDCAPPING WITH AN OXAZOLINE OR OXAZINE TEIJIN LIMITED (JP) 1982-09-28 US disclosed
EP-0030350-A1 Method for reducing the terminal carboxyl group content of a saturated polyester, a saturated polyester having a reduced terminal carboxyl group content, and a molded article composed of such a saturated polyester TEIJIN LIMITED (JP) 1981-06-17 EP disclosed