SCHEMBL166538

SCHEMBL166538

Nc1cccc(CC(=O)O)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.58
MAOA P21397 2/20 0.55
MAOB P27338 2/20 0.55
CYP1A2 P05177 1/20 0.53
CYP2C19 P33261 1/20 0.53
GABRP O00591 1/20 0.52
GABRD O14764 1/20 0.52
GABRA1 P14867 1/20 0.52
GABRB1 P18505 1/20 0.52
GABRG2 P18507 1/20 0.52
GABRB3 P28472 1/20 0.52
GABRA5 P31644 1/20 0.52
GABRA3 P34903 1/20 0.52
GABRA2 P47869 1/20 0.52
GABRB2 P47870 1/20 0.52
GABRA4 P48169 1/20 0.52
GABRE P78334 1/20 0.52
GABRA6 Q16445 1/20 0.52
GABRG1 Q8N1C3 1/20 0.52
GABRG3 Q99928 1/20 0.52

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 SCHEMBL2884824 0.98 MAOA (0.57) AKR1B1MAOAMAOBCYP1A2CYP2C19
Propionic Acid SCHEMBL29093800 0.93 CYP1A2 (0.51) AKR1B1MAOAMAOBCYP1A2CYP2C19
SCHEMBL11071460 0.93 CYP1A2 (0.51) AKR1B1MAOAMAOBCYP1A2CYP2C19
Pyrrole SCHEMBL11630957 0.91 AKR1B1 (0.48) AKR1B1MAOAMAOBCYP1A2CYP2C19
3-Chloroaniline SCHEMBL11667901 0.89 ALDH1A1 (0.57) AKR1B1MAOAMAOBCYP1A2CYP2C19
SCHEMBL11665551 0.89 CTBP2 (0.50) AKR1B1MAOAMAOBCYP1A2CYP2C19
SCHEMBL11665472 0.88 CYP19A1 (0.47) AKR1B1MAOAMAOBCYP1A2CYP2C19
4-Chloroaniline SCHEMBL11666831 0.88 PTGDR2 (0.52) AKR1B1MAOAMAOBCYP1A2CYP2C19
SCHEMBL11664778 0.88 CYP19A1 (0.47) AKR1B1MAOAMAOBCYP1A2CYP2C19
4-Bromoaniline SCHEMBL11664703 0.88 PPARD (0.48) AKR1B1MAOAMAOBCYP1A2CYP2C19

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 1201 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025243208-A2 PROCESS FOR THE PREPARATION AND/OR PURIFICATION OF POLYETHYLENE GLYCOL AND ITS DERIVATIVES, OBTAINED PRODUCT AND USES THEREOF HOVIONE - FARMACIÊNCIA, SA (PT) 2025-11-27 WO claimed
CN-120042069-A Wear-resistant radiation-proof functional fabric and preparation method thereof 南通莎玛纺织品有限公司 2025-05-27 CN claimed
CN-119591822-A Polytetrahydrofuran ether amine polyurea with high elongation at break and preparation method and application thereof 北京九天行歌航天科技有限公司 2025-03-11 CN claimed
CN-114057917-B Post-treatment ashless dispersant and preparation method thereof 中国石油天然气股份有限公司 2024-03-26 CN claimed
CN-113105736-B Soft polyurethane foam plastic and preparation process thereof 兴邦新材料(山东)有限公司 2022-11-08 CN claimed
CN-114773827-A Soft polyurethane foam plastic 池秀林 2022-07-22 CN claimed
CN-113105736-A Soft polyurethane foam plastic and preparation process thereof 池秀林 2021-07-13 CN claimed
EP-3059004-B1 METHOD FOR REMOVING SOX FROM GAS WITH COMPLEX ALCOHOL-AMINE SOLUTION BEIJING BOYUAN HENGSHENG HIGH TECH CO LTD (CN) 2021-06-30 EP claimed
US-9999852-B2 Method for removing SOx from gas with compound alcohol-amine solution BEIJING BOYUAN HENGSHENG HIGH-TECHNOLOGY CO., LTD (CN) 2018-06-19 US claimed
US-9992996-B2 Bioactive aniline copolymers AUCKLAND UNISERVICES LTD (NZ) 2018-06-12 US claimed
EP-1300135-A1 Agent for dyeing keratinous fibres Henkel Kommanditgesellschaft auf Aktien (DE) 2003-04-09 EP claimed
EP-1300134-A2 Agent for dyeing keratinous fibres with isophthalaldehydes Henkel Kommanditgesellschaft auf Aktien (DE) 2003-04-09 EP claimed
US-5866608-A AROMATIC COMPOUNDS BIORESEARCH, INC. (US) 1999-02-02 US claimed
WO-1998001136-A9 FORMULATIONS OF VESICANT DRUGS AND METHODS OF USE THEREOF 1998-04-23 WO claimed
WO-1998001136-A1 FORMULATIONS OF VESICANT DRUGS AND METHODS OF USE THEREOF BAYLOR COLLEGE OF MEDICINE (US) 1998-01-15 WO claimed
EP-0113242-B1 CEPHALOSPORIN DERIVATIVES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1989-11-08 EP claimed
EP-0113242-A2 Cephalosporin derivatives KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1984-07-11 EP claimed
US-4308269-A ANTITUMOUR AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1981-12-29 US claimed
EP-0021173-A1 Maytansinoids, their production and use Takeda Chemical Industries, Ltd. (JP) 1981-01-07 EP claimed
US-4067726-A 3-Ureido phenylacetamide herbicides BAYER AKTIENGESELLSCHAFT (DT) 1978-01-10 US claimed