SCHEMBL7226853

SCHEMBL7226853

NCCCC[C@H](NOCc1ccccc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.50
MMP9 P14780 1/20 0.50
ECE1 P42892 1/20 0.48
CPB1 P15086 1/20 0.48
CPB2 Q96IY4 1/20 0.48
LTA4H P09960 1/20 0.48
ITGB3 P05106 5/20 0.47
ITGA2B P08514 5/20 0.47
TLR2 O60603 2/20 0.47
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
ANPEP P15144 1/20 0.45
EPOR P19235 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
SCHEMBL7226850 1.00 MMP2 (0.50) MMP2MMP9ECE1CPB1CPB2
Methane SCHEMBL28261132 0.99 MMP2 (0.49) MMP2MMP9ECE1CPB1CPB2
SCHEMBL3982664 0.96 NPC1 (0.46) MMP2MMP9ECE1CPB1CPB2
Charcoal, Activated SCHEMBL29433728 0.87 ANPEP (0.55) ECE1CPB1CPB2LTA4HTLR2
Hydrochloric Acid SCHEMBL29433727 0.85 ANPEP (0.54) ECE1CPB1CPB2LTA4HTLR2
SCHEMBL28937048 0.84 LTA4H (0.46) MMP2LTA4HNPC1RAB9A
SCHEMBL9556097 0.84 LTA4H (0.46) MMP2LTA4HNPC1RAB9A
SCHEMBL6158695 0.84 CA1 (0.59) MMP2ECE1
SCHEMBL6158692 0.84 CA1 (0.59) MMP2ECE1
SCHEMBL9440248 0.83 FOLH1 (0.53) MMP2MMP9CPB1CPB2ITGB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118515908-A Modified polyurethane environment-friendly sponge and preparation method thereof 伟建实业(苏州)有限公司 2024-08-20 CN claimed
CN-113444502-B Multifunctional liquid for drilling well, drilling fluid for shale gas, and preparation method and application thereof 长江大学 2023-08-25 CN claimed
CN-110755629-B Step-by-step response type double-gene delivery system and preparation method thereof 天津大学 2022-09-23 CN claimed
EP-0396709-A4 HUMAN LEUKOCYTE ELASTASE INHIBITORS AND METHODS OF PRODUCING AND USING SAME 1991-05-22 EP claimed
EP-0396709-A1 HUMAN LEUKOCYTE ELASTASE INHIBITORS AND METHODS OF PRODUCING AND USING SAME UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 1990-11-14 EP claimed
CN-118515908-A Modified polyurethane environment-friendly sponge and preparation method thereof 伟建实业(苏州)有限公司 2024-08-20 CN disclosed
CN-117881779-A Microorganism and use thereof 英国研究与创新署 2024-04-12 CN disclosed
CN-113444502-B Multifunctional liquid for drilling well, drilling fluid for shale gas, and preparation method and application thereof 长江大学 2023-08-25 CN disclosed
CN-110755629-B Step-by-step response type double-gene delivery system and preparation method thereof 天津大学 2022-09-23 CN disclosed
US-6576780-B1 Hydroxyamidino derivatives useful as nitric oxide synthase inhibitors GD SEARLE & COMPANY 2003-06-10 US disclosed
US-6207708-B1 FOR THERAPY AND PROPHYLAXIS OF AUTOIMMUNE AND/OR INFLAMMATORY CONDITIONS AFFECTING THE JOINTS SUCH AS ARTHRITIS, AND INFLAMMATORY BOWEL DISEASE, CARDIVASCULAR ISCHEMIA, DIABETES, CONGESTIVE HEART FAILURE, MYOCARDITIS, ATHEROSCLEROSIS, G. D. SEARLE & COMPANY 2001-03-27 US disclosed
EP-0885188-B1 HYDROXYAMIDINO DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS SEARLE & CO (US) 2000-09-27 EP disclosed
WO-1997032844-A9 HYDROXYAMIDINO DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS 1997-12-24 WO disclosed
WO-1997032844-A1 HYDROXYAMIDINO DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS G.D. SEARLE & CO. (US) 1997-09-12 WO disclosed
EP-0154343-B1 ADSORBENT Research Development Corporation of Japan (JP) 1991-06-19 EP disclosed
EP-0396709-A4 HUMAN LEUKOCYTE ELASTASE INHIBITORS AND METHODS OF PRODUCING AND USING SAME 1991-05-22 EP disclosed
EP-0396709-A1 HUMAN LEUKOCYTE ELASTASE INHIBITORS AND METHODS OF PRODUCING AND USING SAME UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 1990-11-14 EP disclosed
US-4785021-A OPTICAL RESOLUTION RESEARCH DEVELOPMENT CORP. OF JAPAN (JP) 1988-11-15 US disclosed
US-4694044-A Adsorbent RESEARCH DEVELOPMENT CORP. OF JAPAN (JP) 1987-09-15 US disclosed
EP-0154343-A2 Adsorbent Research Development Corporation of Japan (JP) 1985-09-11 EP disclosed