SCHEMBL487259

SCHEMBL487259

OCN(CO)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.44
NPSR1 Q6W5P4 2/20 0.42
ALDH1A1 P00352 4/20 0.39
KMT2A Q03164 4/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
GLA P06280 1/20 0.39
CYP2C19 P33261 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CYP2D6 P10635 2/20 0.37
TAAR1 Q96RJ0 1/20 0.37
MEN1 O00255 3/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
Hydrochloric Acid SCHEMBL28375845 0.97 TSHR (0.43) TSHRNPSR1ALDH1A1KMT2ANPC1
SCHEMBL6280091 0.85 TSHR (0.59) TSHRALDH1A1KMT2ANPC1RAB9A
SCHEMBL28940337 0.85 ALDH1A1 (0.45) TSHRNPSR1ALDH1A1KMT2ANPC1
SCHEMBL547411 0.83 TDP1 (0.47) TSHRNPSR1ALDH1A1KMT2ANPC1
SCHEMBL7354477 0.83 TSHR (0.63) TSHRALDH1A1KMT2ANPC1RAB9A
SCHEMBL23468470 0.81 MEN1 (0.40) TSHRNPSR1ALDH1A1KMT2AGLA
SCHEMBL19168912 0.79 TSHR (0.39) TSHRNPSR1ALDH1A1KMT2ANPC1
SCHEMBL78451 0.78 KDM4E (0.46) TSHRNPSR1ALDH1A1KMT2ANPC1
SCHEMBL19461689 0.78 HPGD (0.60) NPSR1ALDH1A1KMT2ANPC1RAB9A
SCHEMBL5928168 0.77 KDM4E (0.44) TSHRNPSR1ALDH1A1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118324801-B Preparation method and application of PVC flame-retardant plasticizer 山东振曦新材料科技有限公司 2024-08-20 CN claimed
CN-118324801-A Preparation method and application of PVC flame-retardant plasticizer 山东振曦新材料科技有限公司 2024-07-12 CN claimed
CN-105153905-B A kind of preparation method and applications of graphene modified polyurethane film forming agent 泰山玻璃纤维有限公司 2017-12-01 CN claimed
CN-118324801-B Preparation method and application of PVC flame-retardant plasticizer 山东振曦新材料科技有限公司 2024-08-20 CN disclosed
CN-118324801-B Preparation method and application of PVC flame-retardant plasticizer 山东振曦新材料科技有限公司 2024-08-20 CN disclosed
CN-118324801-A Preparation method and application of PVC flame-retardant plasticizer 山东振曦新材料科技有限公司 2024-07-12 CN disclosed
WO-2022234003-A1 CD33 BINDING POLYPEPTIDES WITH STEFIN A PROTEIN AVACTA LIFE SCIENCES LIMITED (GB) 2022-11-10 WO disclosed
CN-113667099-A Single-component epoxy resin based on amino acid type curing agent 中国科学院宁波材料技术与工程研究所 2021-11-19 CN disclosed
EP-3801634-A2 TUMOR MICROENVIRONMENT-ACTIVATED DRUG-BINDER CONJUGATES, AND USES RELATED THERETO Trustees of Tufts College (US) 2021-04-14 EP disclosed
CN-111875763-A Aniline-modified solid thermosetting phenolic resin and preparation method thereof 杭摩新材料集团股份有限公司 2020-11-03 CN disclosed
CN-111295175-A Curable composition for dental use 株式会社GC 2020-06-16 CN disclosed
US-20060029811-A1 mixing a phenolic compound containing the inorganic microfine particle(SiO2) and a compound containing at least one of the glycidyl group and/or an epoxy group containing the inorganic microfine particle; fireproofing; good mechanical properties; heat resistance; automobiles, construction, electronics NIPPON SHOKUBAI CO., LTD. (JP) 2006-02-09 US disclosed
EP-1607423-A1 AQUEOUS SILYLATED URETHANE COMPOSITION, AQUEOUS ADHESIVES FOR WRAPPING, AND AQUEOUS CONTACT ADHESIVES Konishi Co., Ltd. (JP) 2005-12-21 EP disclosed
WO-2005078019-A1 UNSATURATED POLYESTER RESINS OR VINYL ESTER RESIN COMPOSITIONS DSM IP ASSETS B.V. (NL) 2005-08-25 WO disclosed
EP-1564253-A1 Unsaturated polyester resins or vinyl ester resin compositions DSM IP Assets B.V. (NL) 2005-08-17 EP disclosed
EP-1507829-A1 FIRE RETARDANT RESIN COMPOSITION, METHOD OF ITS PRODUCTION, SHAPED ARTICLES COMPRISING THE SAME, AND SILICA Nippon Shokubai Co., Ltd. (JP) 2005-02-23 EP disclosed
US-20040063892-A1 Non-aqueous laminate adhesive NIPPON POLYURETHANE INDUSTRY CO., LTD. (JP) 2004-04-01 US disclosed
WO-2003099934-A1 FIRE RETARDANT RESIN COMPOSITION, METHOD OF ITS PRODUCTION, SHAPED ARTICLES COMPRISING THE SAME, AND SILICA NIPPON SHOKUBAI CO., LTD. (JP) 2003-12-04 WO disclosed
US-20030092868-A1 Non-aqueous laminate adhesive NIPPON POLYURETHANE INDUSTRY CO., LTD. (JP) 2003-05-15 US disclosed
US-4477635-A Polymeric triarylmethane dyes MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1984-10-16 US disclosed