SCHEMBL3981177

SCHEMBL3981177

CCCCOC(=O)C(N)CCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 2/20 0.52
S1PR1 P21453 2/20 0.49
S1PR3 Q99500 2/20 0.49
GRM8 O00222 1/20 0.48
GRM6 O15303 1/20 0.48
GRIN2D O15399 1/20 0.48
GRIN3B O60391 1/20 0.48
GSR P00390 1/20 0.48
CYP1A2 P05177 1/20 0.48
GRIK1 P39086 1/20 0.48
GRM5 P41594 1/20 0.48
GRIA1 P42261 1/20 0.48
GRIA2 P42262 1/20 0.48
GRIA3 P42263 1/20 0.48
SLC1A3 P43003 1/20 0.48
SLC1A2 P43004 1/20 0.48
SLC1A1 P43005 1/20 0.48
GRIA4 P48058 1/20 0.48
GRIN1 Q05586 1/20 0.48
GRIN2A Q12879 1/20 0.48

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
SCHEMBL345917 1.00 NOD1 (0.52) NOD1S1PR1S1PR3GRM8GRM6
SCHEMBL18030282 1.00 NOD1 (0.52) NOD1S1PR1S1PR3GRM8GRM6
Hydrochloric Acid SCHEMBL8725894 0.98 NOD1 (0.51) NOD1S1PR1S1PR3GRM8GRM6
Hydrochloric Acid SCHEMBL14719874 0.98 NOD1 (0.51) NOD1S1PR1S1PR3GRM8GRM6
SCHEMBL30559 0.95 NOD1 (0.58) NOD1S1PR1S1PR3GRM8GRM6
SCHEMBL16124530 0.95 NOD1 (0.58) NOD1S1PR1S1PR3GRM8GRM6
Hydrochloric Acid SCHEMBL23510799 0.93 NOD1 (0.56) NOD1S1PR1S1PR3GRM8GRM6
SCHEMBL5495191 0.93 NOD1 (0.56) NOD1S1PR1S1PR3GRM8GRM6
SCHEMBL7781960 0.93 NOD1 (0.60) NOD1S1PR1S1PR3ALDH1A1PPARG
SCHEMBL1220169 0.93 NOD1 (0.60) NOD1S1PR1S1PR3ALDH1A1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023040793-A1 ANTI-INFLAMMATORY COMPOUND AND USE THEREOF 映恩生物制药(苏州)有限公司 2023-03-23 WO disclosed
CN-112812009-B Preparation method of 2-bromo-dibutyl glutarate 江苏恒沛药物科技有限公司 2022-05-03 CN disclosed
CN-112812009-A Preparation method of 2-bromo-dibutyl glutarate 江苏恒沛药物科技有限公司 2021-05-18 CN disclosed
EP-3684416-A1 PSMA-TARGETING AMANITIN CONJUGATES Heidelberg Pharma Research GmbH (DE) 2020-07-29 EP disclosed
CN-108218739-B Butyrylglutamic acid derivative, and composition and application thereof 广州英赛特生物技术有限公司 2020-05-01 CN disclosed
WO-2019057964-A1 PSMA-TARGETING AMANITIN CONJUGATES HEIDELBERG PHARMA RESEARCH GMBH (DE) 2019-03-28 WO disclosed
CN-106518702-A Aspergillomarasimine A and derivative, synthetic method and application thereof 北京大学 2017-03-22 CN disclosed
EP-3021879-A2 METHODS, SYSTEMS, AND COMPOSITIONS FOR PROMOTING BONE GROWTH Cayman Chemical Company, Incorporated (US) 2016-05-25 EP disclosed
EP-2989098-A2 LACTAM COMPOUNDS AS EP4 RECEPTOR-SELECTIVE AGONISTS FOR USE IN THE TREATMENT OF EP4-MEDIATED DISEASES AND CONDITIONS Cayman Chemical Company, Incorporated (US) 2016-03-02 EP disclosed
US-20150175530-A1 ANTIBACTERIAL AGENTS ACHAOGEN, INC. 2015-06-25 US disclosed
EP-1656390-A2 COMPOSITIONS OF LIPOPEPTIDE ANTIBIOTIC DERIVATIVES AND METHODS OF USE THEREOF MIGENIX INC. (CA) 2006-05-17 EP disclosed
EP-1335898-B1 CARBAMIC ACID COMPOUNDS COMPRISING AN AMIDE LINKAGE AS HDAC INHIBITORS TOPOTARGET UK LTD (GB) 2005-11-23 EP disclosed
WO-2005000878-A2 COMPOSITIONS OF LIPOPEPTIDE ANTIBIOTIC DERIVATIVES AND METHODS OF USE THEREOF MIGENIX INC. (CA) 2005-01-06 WO disclosed
EP-1335898-A1 CARBAMIC ACID COMPOUNDS COMPRISING AN AMIDE LINKAGE AS HDAC INHIBITORS Prolifix Limited (GB) 2003-08-20 EP disclosed
CN-1098908-C Compound film with colour changing according to absorbed moisture quantity and making method thereof GUANGZHOU INST OF CHEMISTRY (CN) 2003-01-15 CN disclosed
WO-2002026696-A1 CARBAMIC ACID COMPOUNDS COMPRISING AN AMIDE LINKAGE AS HDAC INHIBITORS PROLIFIX LIMITED (GB) 2002-04-04 WO disclosed
CN-1060504-C Solid composite colour film and manufacture thereof GUANGZHOU CHEM INST (CN) 2001-01-10 CN disclosed
CN-1223289-A Compound film with colour changing according to absorbed moisture quantity and making method thereof GUANGZHOU INST OF CHEMISTRY (CN) 1999-07-21 CN disclosed
CN-1178328-A Solid composite colour film and manufacture thereof GUANGZHOU CHEM INST (CN) 1998-04-08 CN disclosed
CN-1076704-A Solid composite colour film and method for making with cholester structure GUANGZHOU CHEM INST (CN) 1993-09-29 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150175530-A1 ANTIBACTERIAL AGENTS MRPL21, ABCB11, LSS NOD1 775/4885S1PR1 2966/4885S1PR3 3538/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.