SCHEMBL542444

SCHEMBL542444

CC(C)C(N)C(=O)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC15A1 P46059 1/20 0.61
ALDH1A1 P00352 4/20 0.56
SLC1A3 P43003 2/20 0.51
SLC1A2 P43004 2/20 0.51
SLC1A1 P43005 2/20 0.51
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
MAPK1 P28482 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A3 Q01959 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CTSB P07858 1/20 0.48
LTA4H P09960 2/20 0.48
LAP3 P28838 1/20 0.48
LMNA P02545 2/20 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
SCHEMBL354949 1.00 SLC15A1 (0.61) SLC15A1ALDH1A1SLC1A3SLC1A2SLC1A1
SCHEMBL2137609 1.00 SLC15A1 (0.61) SLC15A1ALDH1A1SLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL2135391 0.98 SLC15A1 (0.59) SLC15A1ALDH1A1SLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL7275901 0.98 SLC15A1 (0.59) SLC15A1ALDH1A1SLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL542587 0.98 SLC15A1 (0.59) SLC15A1ALDH1A1SLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL2137602 0.98 SLC15A1 (0.59) SLC15A1ALDH1A1SLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL7275897 0.98 SLC15A1 (0.59) SLC15A1ALDH1A1SLC1A3SLC1A2SLC1A1
Valine SCHEMBL28244846 0.95 SLC15A1 (0.60) SLC15A1ALDH1A1SLC1A3SLC1A2SLC1A1
Valine SCHEMBL28244847 0.95 SLC15A1 (0.60) SLC15A1ALDH1A1SLC1A3SLC1A2SLC1A1
Lactic Acid SCHEMBL28307486 0.94 SLC15A1 (0.59) SLC15A1ALDH1A1SLC1A3SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112812149-B Amino acid derivative, preparation method and application thereof, anti-tumor micelle and preparation method thereof 首都医科大学 2022-04-29 CN claimed
CN-107698660-B imidazopyridine-6-formyl-Lys (Lys) -oligopeptides, their synthesis, activity and uses 首都医科大学 2021-06-08 CN claimed
CN-106349332-B imidazopyridinyl-KRGDV, its synthesis, antithrombotic activity and use 首都医科大学 2019-12-10 CN claimed
CN-107698660-A Imidazopyridine -6- formyls-Lys (Lys)-oligopeptides, it is synthesized, activity and application 首都医科大学 2018-02-16 CN claimed
CN-107033215-A Imidazopyridine acyl-KAGDV, it is synthesized, antithrombotic acitivity and application 首都医科大学 2017-08-11 CN claimed
CN-106349332-A Imidazo pyridine acyl-KRGDV, synthesis thereof, antithrombus activity and application 首都医科大学 2017-01-25 CN claimed
CN-103159827-B (1R, 3S)-1-p-nitrophenyl-tetrahydro-beta-carboline amic acid, its synthesis, anti-thrombus activity and application Capital Medical University (CN) 2016-03-30 CN claimed
CN-103159758-B (1S, 3S)-1-p-nitrophenyl-1,2,3,4-tetrahydro-beta-carboline amic acid, its synthesis, anti-thrombus activity and the application as antithrombotic agent Capital Medical University (CN) 2015-08-05 CN claimed
CN-103554047-A Method for preparing valsartan ZHENJIANG COLLEGE 2014-02-05 CN claimed
CN-102241675-B (1R,3S)-1-(4-hydroxyl-3-methoxycarboxyl)-1,2,3,4-tetrahydro-beta-carboline-3-formyl amino acid derivatives as well as preparation method and application thereof UNIV CAPITAL MEDICAL 2013-06-19 CN claimed
CN-103159827-A Synthesis, anti-thrombotic activity, and application of (1R, 3S) -1-p-nitrophenyl-1,2,3,4-tetrahydro-beta-carboline acyl amino acid UNIV CAPITAL MEDICAL 2013-06-19 CN claimed
CN-103159758-A (1S,3S)-1-p-nitrophenyl-1,2,3,4-tetrahydro-beta-carboline acyl amino acid, and synthesis, antithrombotic activity and application as antithrombotic agent thereof UNIV CAPITAL MEDICAL 2013-06-19 CN claimed
EP-2152678-A1 PROCESS FOR PREPARING VALSARTAN Cipla Limited (IN) 2010-02-17 EP claimed
WO-2008135762-A1 PROCESS FOR PREPARING VALSARTAN CIPLA LIMITED (IN) 2008-11-13 WO claimed
WO-2008012852-A1 INTERMEDIATE COMPOUNDS FOR THE PREPARATION OF ANGIOTENSIN II ANTAGONISTS S.I.M.S. S.r.l. - SOCIETÀ ITALIANA MEDICINALI SCANDICCI (IT) 2008-01-31 WO claimed
US-5602161-A ELASTASE INHIBITORS; PREVENTING AND TREATING EMPHYSEMA, ENDOTOXIN-INDUCED LUNG DISORDERS WAKAMOTO PHARMACEUTICAL CO., LTD. (JP) 1997-02-11 US claimed
EP-0676396-A1 Tetrazolylphenyl pivalate derivatives and medicinal composition containing the same as effective component Wakamoto Pharmaceutical Co., Ltd. (JP) 1995-10-11 EP claimed
CN-116617403-B Amino acid modified ionic liquid and preparation method and application thereof 北京大学 2026-05-19 CN disclosed
EP-0268343-A2 Enzymatic process for 3-substituted cephalosporins THE CHANCELLOR, MASTERS AND SCHOLARS OF THE UNIVERSITY OF OXFORD (GB) 1988-05-25 EP disclosed
US-4000139-A ERGOT ALKALOID INTERMEDIATES SANDOZ LTD. (CH) 1976-12-28 US disclosed