SCHEMBL1685334

SCHEMBL1685334

CC1CCCCC1(C)OC(=O)c1ccccc1C(=O)OC1(C)CCCCC1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP2D6 P10635 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 4/20 0.38
ALDH1A1 P00352 3/20 0.38
HSD17B10 Q99714 2/20 0.38
HPGD P15428 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SCN1A P35498 2/20 0.37
SCN2A Q99250 2/20 0.37
SCN3A Q9NY46 2/20 0.37
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
MAPK1 P28482 1/20 0.35
TSHR P16473 2/20 0.35
RECQL P46063 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL1685335 0.94 CYP3A4 (0.47) CYP3A4CYP2C9CYP2C19CYP2D6TDP1
SCHEMBL28944642 0.92 ALDH1A1 (0.46) CYP3A4CYP2C9CYP2C19TDP1KDM4E
Ammonia Solution, Strong SCHEMBL8469605 0.85 GAA (0.40) CYP2D6TDP1SCN1ASCN2ASCN3A
SCHEMBL6900836 0.84 MAPT (0.39) CYP2C9CYP2C19CYP2D6ALDH1A1HPGD
SCHEMBL11763859 0.79 RXRA (0.38) CYP2C19ALDH1A1MAPK1TSHR
SCHEMBL11061843 0.78 CYP2C9 (0.41) CYP3A4CYP2C9CYP2C19CYP2D6TDP1
SCHEMBL11494838 0.76 SMN1; SMN2 (0.35) ALDH1A1HPGDMAPK1NPC1RAB9A
SCHEMBL3411398 0.75 SCN1A (0.54) CYP3A4CYP2C9CYP2C19CYP2D6TDP1
SCHEMBL31077823 0.75 SCN1A (0.54) CYP3A4CYP2C9CYP2C19CYP2D6TDP1
SCHEMBL27896935 0.75 ALOX15 (0.34) LMNACYP1A2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118652532-A Low-VOC high-antistatic deformation rapid recovery thermoplastic polyether ester elastomer composite material, preparation method thereof and 3D hollow fiber structure 会通新材料股份有限公司 2024-09-17 CN claimed
CN-118599295-A High-melting high-resilience antistatic thermoplastic polyether ester elastomer material, preparation method thereof and high-permeability 3D hollow fiber structure with excellent low-pressure-variation fatigue resistance durability 会通新材料股份有限公司 2024-09-06 CN claimed
EP-4369936-A1 FLEA AND TICK COLLAR Wellmark International (US) 2024-05-22 EP claimed
EP-3612182-B1 RUPATADINE-CONTAINING PATCH TEIKOKU SEIYAKU KK (JP) 2024-01-10 EP claimed
US-20230028884-A1 FLEA AND TICK COLLAR WELLMARK INTERNATIONAL (US) 2023-01-26 US claimed
WO-2023287904-A1 FLEA AND TICK COLLAR WELLMARK INTERNATIONAL (US) 2023-01-19 WO claimed
CN-109071988-B Method for producing three-dimensional structures or structural elements on a substrate surface 弗劳恩霍夫应用研究促进协会 2022-02-25 CN claimed
US-11179346-B2 Rupatadine-containing patch TEIKOKU SEIYAKU CO., LTD. (JP) 2021-11-23 US claimed
US-20200121612-A1 RUPATADINE-CONTAINING PATCH TEIKOKU SEIYAKU CO., LTD. (JP) 2020-04-23 US claimed
EP-3612182-A1 RUPATADINE-CONTAINING PATCH Teikoku Seiyaku Co., Ltd. (JP) 2020-02-26 EP claimed
WO-2018194183-A1 RUPATADINE-CONTAINING PATCH TEIKOKU SEIYAKU CO., LTD. (JP) 2018-10-25 WO claimed
US-9273217-B2 Composition that can be screen printed onto polyvinyl butyral SAINT-GOBAIN GLASS FRANCE (FR) 2016-03-01 US claimed
EP-0456473-B1 Polyvinyl chloride based resin composition TOSOH CORP (JP) 1999-07-14 EP claimed
EP-0633896-B1 ESTERIFIED STARCH COMPOSITION NAT STARCH CHEM INVEST (US) 1998-06-17 EP claimed
US-5587412-A MELT PROCESSABILITY NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1996-12-24 US claimed
US-5527616-A CROSSLINKED POLYESTERURETHANE COPOLYMER HOT MELT ADHESIVE TOYO SEIKAN KAISHA LTD. (JP) 1996-06-18 US claimed
EP-0633896-A1 ESTERIFIED STARCH COMPOSITION National Starch and Chemical Investment Holding Corporation (US) 1995-01-18 EP claimed
US-5264473-A Mixed with specific class of phthalic acid esters and phosphoric acid esters; absorbs vibration a energy TOSOH CORPORATION (JP) 1993-11-23 US claimed
WO-1993020110-A1 ESTERIFIED STARCH COMPOSITION PARKE-DAVIS & COMPANY (US) 1993-10-14 WO claimed
US-4677003-A POLYMERS/SHELL-CORE ROHM AND HAAS COMPANY (US) 1987-06-30 US claimed