SCHEMBL575895

SCHEMBL575895

CCCCSc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.64
MAPK1 P28482 1/20 0.64
MAOA P21397 2/20 0.52
MAOB P27338 2/20 0.52
MAPT P10636 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2D6 P10635 2/20 0.47
CYP2C19 P33261 2/20 0.47
KDM4E B2RXH2 1/20 0.46
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46

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
SCHEMBL4179998 1.00 ALDH1A1 (0.64) ALDH1A1MAPK1MAOAMAOBMAPT
Fluoride SCHEMBL27793289 0.98 ALDH1A1 (0.61) ALDH1A1MAPK1MAOAMAOBMAPT
Ammonia Solution, Strong SCHEMBL19133464 0.98 ALDH1A1 (0.61) ALDH1A1MAPK1MAOAMAOBMAPT
Fluoride SCHEMBL943089 0.98 ALDH1A1 (0.61) ALDH1A1MAPK1MAOAMAOBMAPT
SCHEMBL23289811 0.96 ALDH1A1 (0.58) ALDH1A1MAPK1MAOAMAOBMAPT
Hydrochloric Acid SCHEMBL27772312 0.96 ALDH1A1 (0.58) ALDH1A1MAPK1MAOAMAOBMAPT
SCHEMBL2860864 0.93 ALDH1A1 (0.61) ALDH1A1MAPK1MAOAMAOBCYP1A2
SCHEMBL7151793 0.92 ALDH1A1 (0.54) ALDH1A1MAPK1MAOAMAOBMAPT
SCHEMBL5694452 0.91 ALDH1A1 (0.58) ALDH1A1MAPK1KDM4EHDAC3HDAC4
SCHEMBL8082721 0.91 ALDH1A1 (0.58) ALDH1A1MAPK1KDM4EHDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023104155-A1 LIGAND COMPOUNDS FOR E3 UBIQUITIN LIGASE, PROTEIN DEGRADERS DEVELOPED ON BASIS OF LIGAND COMPOUNDS, AND USES THEREOF 标新生物医药科技(上海)有限公司 2023-06-15 WO claimed
EP-2481760-B1 INITIATOR SYSTEM FOR CATIONIC POLYMERIZATION AND POLYMERIZATION METHOD USING SAME CHINA PETROLEUM & CHEM CORP (CN) 2021-05-05 EP claimed
CN-103429605-B Ribofuranosylpurine class compound and its preparation method and application 北京康倍得医药技术开发有限公司 2017-11-07 CN claimed
CN-107141391-A A kind of quasi- random copolymer of ethylene polar styrene and preparation method thereof 中国科学院长春应用化学研究所 2017-09-08 CN claimed
US-9499880-B2 System and process for production of magnesium metal and magnesium hydride from magnesium-containing salts and brines BATTELLE MEMORIAL INSTITUTE (US) 2016-11-22 US claimed
WO-2016144396-A1 SYSTEM AND PROCESS FOR PRODUCTION OF MAGNESIUM METAL AND MAGNESIUM HYDRIDE FROM MAGNESIUM-CONTAINING SALTS AND BRINES BATTELLE MEMORIAL INSTITUTE (US) 2016-09-15 WO claimed
US-20160258037-A1 SYSTEM AND PROCESS FOR PRODUCTION OF MAGNESIUM METAL AND MAGNESIUM HYDRIDE FROM MAGNESIUM-CONTAINING SALTS AND BRINES BATTELLE MEMORIAL INSTITUTE (US) 2016-09-08 US claimed
CN-102532368-B Rare earth catalyst and method for polymerizing conjugated diene by using same UNIV BEIJING CHEMICAL 2014-04-02 CN claimed
CN-103429605-A Ribofuranosyl purine compound, preparation method therefor, and use thereof UNIV BEIJING CHEMICAL 2013-12-04 CN claimed
CN-102532368-A Rare earth catalyst and method for polymerizing conjugated diene by using same UNIV BEIJING CHEMICAL 2012-07-04 CN claimed
EP-1195259-B1 Sheet for ink jet-recording OJI PAPER CO (JP) 2007-04-25 EP claimed
US-6652930-B2 Comprises mixture of compounds such as 1,2-bis(2-hydroxyethyl thio)ethane and homo/copolymers of diallylamine compounds such as polydiallylamine hydrochloride; phthalocyanine dye adds to stability; discoloration inhibition extends shelf-life OJI PAPER CO., LTD. (JP) 2003-11-25 US claimed
US-20020071941-A1 Sheet for ink jet-recording OJI PAPER CO., LTD. (JP) 2002-06-13 US claimed
EP-1195259-A2 Sheet for ink jet-recording OJI PAPER CO., LTD. (JP) 2002-04-10 EP claimed
EP-0262061-B1 PROCESS FOR STABILIZING CHLORINATION MIXTURES OF PHENOL AND/OR CHLOROPHENOLS RHONE-POULENC CHIMIE (FR) 1993-02-24 EP claimed
US-4853153-A USING REDUCING AGENT AND CHLORINATED CYCLIC KETONE RHONE-POULENC CHIMIE (FR) 1989-08-01 US claimed
EP-0193475-A1 Process for the acetoacetylation of aromatic compounds RHONE-POULENC CHIMIE (FR) 1986-09-03 EP claimed
CN-122006631-A Device for preparing hydrogen fluoride by molecular recognition complexation method and application thereof 浙江大学衢州研究院 2026-05-12 CN disclosed
US-4124646-A Process for producing thioanisole SEITETSU KAGAKU CO., LTD. (JP) 1978-11-07 US disclosed
US-3958022-A REMOVING HEAVY METAL IONS WITH A COMPLEXING AGENT DANESH ANDRE 1976-05-18 US disclosed