SCHEMBL1685335

SCHEMBL1685335

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

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
ALDH1A1 P00352 5/20 0.38
ALOX15 P16050 2/20 0.38
KDM4E B2RXH2 3/20 0.38
SCN1A P35498 2/20 0.37
SCN2A Q99250 2/20 0.37
SCN3A Q9NY46 2/20 0.37
ABCC1 P33527 2/20 0.35
MAPK1 P28482 1/20 0.35
CETP P11597 1/20 0.35
HSD17B10 Q99714 2/20 0.35
HPGD P15428 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TSHR P16473 1/20 0.34
RECQL P46063 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
SCHEMBL1685334 0.94 CYP3A4 (0.39) CYP3A4CYP2D6CYP2C9CYP2C19TDP1
SCHEMBL28944642 0.86 ALDH1A1 (0.46) CYP3A4CYP2C9CYP2C19TDP1ALDH1A1
Ammonia Solution, Strong SCHEMBL8469605 0.83 GAA (0.40) CYP2D6TDP1SCN1ASCN2ASCN3A
SCHEMBL11763859 0.81 RXRA (0.38) CYP2C19ALDH1A1MAPK1TSHR
SCHEMBL6900836 0.80 MAPT (0.39) CYP2D6CYP2C9CYP2C19ALDH1A1MAPK1
Phthalic Acid SCHEMBL27794663 0.79 SLC18A3 (0.46) CYP3A4CYP2D6CYP2C9CYP2C19TDP1
SCHEMBL6404697 0.77 SCN1A (0.51) CYP3A4CYP2D6CYP2C9CYP2C19TDP1
SCHEMBL3757915 0.75 CYP3A4 (0.46) CYP3A4CYP2D6CYP2C9CYP2C19TDP1
SCHEMBL27896935 0.74 ALOX15 (0.34) ALOX15TSHR
SCHEMBL11367643 0.74 CYP2C9 (0.48) CYP3A4CYP2D6CYP2C9CYP2C19TDP1

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 141 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
CN-110964609-A Detergent for workshop worker working 南京市检捷生物信息科技有限公司 2020-04-07 CN 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
CN-1017339-B Method for producing fine capsule dispersion ROHM & HAAS (US) 1992-07-08 CN claimed
CN-1041116-A Method for producing fine capsule dispersion ROHM & HAAS (US) 1990-04-11 CN claimed
US-4677003-A POLYMERS/SHELL-CORE ROHM AND HAAS COMPANY (US) 1987-06-30 US claimed
CN-86103126-A Method for producing fine capsule dispersion 1986-10-29 CN claimed