SCHEMBL1225614

SCHEMBL1225614

CCCCC(C)(Br)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.39
CA2 P00918 1/20 0.38
MAPK1 P28482 1/20 0.38
GPR84 Q9NQS5 7/20 0.37
PPARG P37231 6/20 0.37
PPARD Q03181 6/20 0.37
PPARA Q07869 6/20 0.37
HDAC11 Q96DB2 5/20 0.37
TSHR P16473 4/20 0.37
ALDH1A1 P00352 2/20 0.37
TLR2 O60603 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
FABP4 P15090 2/20 0.37
PTPN1 P18031 2/20 0.37
SLC22A6 Q4U2R8 1/20 0.37
SLC22A8 Q8TCC7 1/20 0.37
MEN1 O00255 1/20 0.37
ESR1 P03372 1/20 0.37
ALOX15 P16050 1/20 0.37
PDE4A P27815 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
SCHEMBL5075420 0.93 AKR1B1 (0.42) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL22264633 0.91 CES2 (0.45) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL11817654 0.91 CES2 (0.45) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL10998086 0.91 CES2 (0.45) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL22264627 0.91 CES2 (0.45) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL140406 0.87
SCHEMBL16353782 0.87 FFAR1 (0.44) TSHRALDH1A1TDP1FFAR1
Tetrahydrofuran SCHEMBL29252961 0.86 AKR1B1 (0.34) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL6120645 0.84 TSHR (0.42) TSHRALDH1A1TDP1ESR1HSD17B10
SCHEMBL6003058 0.80 AKR1B1 (0.39) AKR1B1GPR84PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113981421-B Method for preparing erasable metal electrode on plastic surface 西安电子科技大学 2022-07-01 CN claimed
CN-113981421-A Method for preparing erasable metal electrode on plastic surface 西安电子科技大学 2022-01-28 CN claimed
CN-113577401-A Long-acting antibacterial and anti-stenosis functional urethral stent and preparation method thereof 南通纺织丝绸产业技术研究院 2021-11-02 CN claimed
CN-111187793-A Method for synthesizing L-2-methyl norleucine 康化(上海)新药研发有限公司 2020-05-22 CN claimed
US-4489207-A DIHYDROXYBENZENE, 2-HALOFATTY ESTER OR ACYLOXIME BASF AKTIENGESELLSCHAFT (DE) 1984-12-18 US claimed
CN-112778193-B Synthesis method of (S) -3- (4-chlorophenyl) -piperidine 康化(上海)新药研发有限公司 2024-03-12 CN disclosed
CN-113577401-B Long-acting antibacterial and anti-stenosis functional urethral stent and preparation method thereof 南通纺织丝绸产业技术研究院 2022-06-07 CN disclosed
CN-113577401-A Long-acting antibacterial and anti-stenosis functional urethral stent and preparation method thereof 南通纺织丝绸产业技术研究院 2021-11-02 CN disclosed
CN-112778193-A Synthesis method of (S) -3- (4-chlorphenyl) -piperidine 康化(上海)新药研发有限公司 2021-05-11 CN disclosed
CN-111187793-A Method for synthesizing L-2-methyl norleucine 康化(上海)新药研发有限公司 2020-05-22 CN disclosed
CN-111187793-A Method for synthesizing L-2-methyl norleucine 康化(上海)新药研发有限公司 2020-05-22 CN disclosed
US-20190232699-A1 PROCESS FOR MANUFACTURING A LASER MARKABLE PACKAGING AGFA NV (BE) 2019-08-01 US disclosed
WO-2008066356-A1 ARYL COMPOUNDS AS PPAR LIGANDS AND THEIR USE SEOUL NATIONAL UNIVERSITY INDUSTRY FOUNDATION (KR) 2008-06-05 WO disclosed
EP-1669406-A1 THERMOPLASTIC ELASTOMER COMPOSITION KANEKA CORPORATION (JP) 2006-06-14 EP disclosed
EP-0789029-B1 Improved procedure for the preparation of pure(S,S)-N-(1-Ethoxycarbonyl-3-phenylprophyl)-alanin). DSM FINE CHEM AUSTRIA GMBH (AT) 2003-09-10 EP disclosed
US-5777151-A REACTING CARBOXYLIC ACID SALT WITH ORGANIC HALOCOMPOUND USING ONIUM SALT PHASE TRANSFER CATALYST RHONE-POULENC CHIMIE (FR) 1998-07-07 US disclosed
EP-0789029-A2 Improved procedure for the preparation of pure(S,S)-N-(1-Ethoxycarbonyl-3-phenylprophyl)-alanin). DSM Chemie Linz GmbH (AT) 1997-08-13 EP disclosed
EP-0019578-B1 PIPERIDINE DERIVATIVES, PROCESS FOR PREPARING THEM AND POLYMER COMPOSITIONS CONTAINING THEM Chimosa Chimica Organica S.p.A. (IT) 1983-03-30 EP disclosed
EP-0019578-A1 Piperidine derivatives, process for preparing them and polymer compositions containing them Chimosa Chimica Organica S.p.A. (IT) 1980-11-26 EP disclosed
US-3975432-A Process for preparing 2-(6-methoxy-2-naphthyl)propionic acid SYNTEX CORPORATION (PM) 1976-08-17 US disclosed