SCHEMBL188590

SCHEMBL188590

N=C(N)NCCC[C@H](NC(=O)c1ccccc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
C3AR1 Q16581 5/20 0.52
PADI1 Q9ULC6 5/20 0.51
PADI4 Q9UM07 5/20 0.51
PADI2 Q9Y2J8 4/20 0.51
PDE4A P27815 3/20 0.51
PADI3 Q9ULW8 3/20 0.51
PDE4B Q07343 2/20 0.51
PDE4C Q08493 2/20 0.51
PDE4D Q08499 2/20 0.51
PADI6 Q6TGC4 1/20 0.51
FOLH1 Q04609 2/20 0.47
CA2 P00918 4/20 0.47
GRIN1 Q05586 1/20 0.46
GRIN2A Q12879 1/20 0.46
ALB P02768 1/20 0.45
CA1 P00915 1/20 0.45

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
SCHEMBL7925397 1.00 C3AR1 (0.52) C3AR1PADI1PADI4PADI2PDE4A
SCHEMBL188589 1.00 C3AR1 (0.52) C3AR1PADI1PADI4PADI2PDE4A
Naphthalene SCHEMBL28216957 0.96 C3AR1 (0.49) C3AR1PADI1PADI4PADI2PDE4A
Alcohol SCHEMBL2258594 0.95 CA2 (0.49) C3AR1PADI1PADI4PADI2PDE4A
Alcohol SCHEMBL29029781 0.95 CA2 (0.49) C3AR1PADI1PADI4PADI2PDE4A
Propane SCHEMBL25417180 0.94 CA2 (0.48) C3AR1PADI1PADI4PADI2PDE4A
Butane SCHEMBL25420420 0.93 CA2 (0.50) C3AR1PADI1PADI4PADI2PDE4A
SCHEMBL10946109 0.92 PADI1 (0.60) C3AR1PADI1PADI4PADI2PDE4A
SCHEMBL158990 0.92 PADI1 (0.60) C3AR1PADI1PADI4PADI2PDE4A
Ether SCHEMBL9150674 0.92 C3AR1 (0.48) C3AR1PADI1PADI4PADI2PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3583226-B1 AMPLIFICATION TECHNOLOGY USING DUAL ENZYME CASCADE DETECTION UNIV CALIFORNIA (US) 2025-07-02 EP claimed
CN-119552593-A Water-based composite binder for silicon-carbon negative electrode of lithium ion battery, preparation method and battery containing binder 郑州大学 2025-03-04 CN claimed
CN-119096144-A Rapid diagnostic test for antibiotic resistance and methods of use and preparation thereof 拜奥普诊断公司 2024-12-06 CN claimed
CN-118703593-A Argininase quantitative detection kit, argininase qualitative detection kit and use method thereof 武汉简为医疗科技有限公司 2024-09-27 CN claimed
CN-111432662-B Pea protein hydrolysate 嘉吉公司 2024-03-19 CN claimed
WO-2024007629-A1 POLYSACCHARIDE TRYPSIN INHIBITOR AND PREPARATION METHOD THEREFOR 山东省分析测试中心 2024-01-11 WO claimed
CN-115068620-A Pharmaceutical composition capable of reducing generation of arylamine impurities 天津睿创康泰生物技术有限公司 2022-09-20 CN claimed
CN-114728008-A Compounds for identifying beta-lactamases and methods of use thereof 加利福尼亚大学董事会 2022-07-08 CN claimed
CN-114196730-A Method and kit for detecting activity of cysteine protease inhibitor in Chinese tulip tree nectar 南京林业大学 2022-03-18 CN claimed
EP-2402037-B1 CONTROLLED RELEASE OF PHENOLIC OPIOIDS SIGNATURE THERAPEUTICS INC (US) 2019-10-23 EP claimed
EP-0784469-A4 COMPOSITIONS FOR THE DELIVERY OF ANTIGENS EMISPHERE TECH INC (US) 1999-03-24 EP claimed
EP-0784469-A1 COMPOSITIONS FOR THE DELIVERY OF ANTIGENS Emisphere Technologies, Inc. (US) 1997-07-23 EP claimed
EP-0754023-A1 INHIBITION OF HAIR GROWTH HANDELMAN, Joseph H. (US) 1997-01-22 EP claimed
WO-1996012474-A1 COMPOSITIONS FOR THE DELIVERY OF ANTIGENS EMISPHERE TECHNOLOGIES, INC. (US) 1996-05-02 WO claimed
US-5468476-A Enzyme inhibitor GILLETTE CO., THE 1995-11-21 US claimed
WO-1995024884-A1 INHIBITION OF HAIR GROWTH HANDELMAN, JOSEPH, H. (US) 1995-09-21 WO claimed
WO-1994016740-A1 THE USE OF NITRIC OXIDE-DELIVERING COMPOUNDS FOR THE TREATMENT OR PREVENTION OF ALCOHOLIC LIVER INJURY BRIGHAM AND WOMEN'S HOSPITAL (US) 1994-08-04 WO claimed
EP-0384362-A2 Glycinderivatives F. HOFFMANN-LA ROCHE AG (CH) 1990-08-29 EP claimed
EP-0044090-A2 Lysosomotropic detergent therapeutic agents, compositions containing them and their uses MERCK & CO. INC. (US) 1982-01-20 EP claimed
EP-0009944-A2 Lysosomotropic fluorinated amine therapeutic agents and compositions containing them MERCK & CO. INC. (US) 1980-04-16 EP claimed