SCHEMBL1143587

SCHEMBL1143587

COC(=O)[C@@H](N)CCC(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 1/20 0.40
LTA4H P09960 4/20 0.39
CA12 O43570 2/20 0.35
CA14 Q9ULX7 2/20 0.35
DGAT1 O75907 1/20 0.34
CA2 P00918 2/20 0.34
CA1 P00915 1/20 0.34
CYP2D6 P10635 1/20 0.34
NOS1 P29475 2/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
NOS3 P29474 1/20 0.33
NOS2 P35228 1/20 0.33
TSHR P16473 1/20 0.32

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
SCHEMBL9725660 1.00 SLC1A1 (0.40) SLC1A1LTA4HCA12CA14DGAT1
SCHEMBL3730273 1.00 SLC1A1 (0.40) SLC1A1LTA4HCA12CA14DGAT1
Hydrochloric Acid SCHEMBL1143881 0.98 SLC1A1 (0.39) SLC1A1LTA4HCA12CA14DGAT1
Hydrochloric Acid SCHEMBL25409265 0.98 SLC1A1 (0.39) SLC1A1LTA4HCA12CA14DGAT1
Hydrochloric Acid SCHEMBL3364146 0.98 SLC1A1 (0.39) SLC1A1LTA4HCA12CA14DGAT1
SCHEMBL18477 0.89 LTA4H (0.43) SLC1A1LTA4HCYP2D6NOS1MEN1
SCHEMBL1841835 0.89 LTA4H (0.43) SLC1A1LTA4HCYP2D6NOS1MEN1
SCHEMBL1654337 0.89 LTA4H (0.43) SLC1A1LTA4HCYP2D6NOS1MEN1
Water SCHEMBL3912787 0.87 LTA4H (0.42) SLC1A1LTA4HCYP2D6NOS1MEN1
SCHEMBL6893763 0.87 LTA4H (0.42) SLC1A1LTA4HCYP2D6NOS1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117030911-A Purity detection method of 5- (tertiary butyl) 1-methyl L-glutamic acid 上海吉奉生物科技有限公司 2023-11-10 CN claimed
US-20240208968-A1 ALPHA V BETA 6 AND ALPHA V BETA 1 INTEGRIN INHIBITORS AND USES THEREOF DICE MOLECULES SV, INC. 2024-06-27 US disclosed
US-20240115553-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN INJURY AZEVAN PHARMACEUTICALS, INC. (US) 2024-04-11 US disclosed
CN-117030911-A Purity detection method of 5- (tertiary butyl) 1-methyl L-glutamic acid 上海吉奉生物科技有限公司 2023-11-10 CN disclosed
CN-117030911-A Purity detection method of 5- (tertiary butyl) 1-methyl L-glutamic acid 上海吉奉生物科技有限公司 2023-11-10 CN disclosed
WO-2023161878-A1 CYTOTOXICITY TARGETING CHIMERAS FOR FOLATE RECEPTOR-EXPRESSING CELLS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-08-31 WO disclosed
CN-116327950-A Use of a composition for the treatment of neuropsychiatric symptoms of neurodegenerative diseases 阿泽范药品公司 2023-06-27 CN disclosed
CN-116139282-A Compositions and methods for treating neurodegenerative diseases 阿泽范药品公司 2023-05-23 CN disclosed
US-20230123729-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASES AZEVAN PHARMACEUTICALS INC (US) 2023-04-20 US disclosed
US-11628160-B2 Compositions and methods for treating brain injury AZEVAN PHARMACEUTICALS, INC. (US) 2023-04-18 US disclosed
US-20040006093-A1 Compounds which inhibit leukocyte adhesion mediated by VLA-4 BIOGEN IDEC INTERNATIONAL HOLDING LTD. (BM) 2004-01-08 US disclosed
US-6583139-B1 Treatment of inflammatory diseases; inflammatory brain diseases such as multiple sclerosis; N-(Toluene-4-sulfonyl)-L-prolyl-4-(alpha -methylbenzyloxy)-L-phenylalanine; Very Late Antigen 4 BIOGEN IDEC INTERNATIONAL HOLDING LTD. (BM) 2003-06-24 US disclosed
US-6420427-B1 PREVENTION AND/OR TREATMENT OF RHEUMATOID DISEASES, ARTHROSTEITIS, UNUSUAL BONE RESORPTION, OSTEOPOROSIS, PERIODONTITIS, INTERSTITIAL NEPHRITIS, ARTERIOSCLEROSIS, PULMONARY EMPHYSEMA, CIRRHOSIS, CORNEA INJURY ONO PHARMACEUTICAL CO., LTD. (JP) 2002-07-16 US disclosed
CN-1318069-A Factor VIIa inhibitors AVENTIS PHARMA DEUTSHLAND GMBH (DE) 2001-10-17 CN disclosed
US-6287794-B1 Factor Vlla inhibitors AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-09-11 US disclosed
EP-1114061-A1 FACTOR VIIa INHIBITORS Aventis Pharma Deutschland GmbH (DE) 2001-07-11 EP disclosed
CN-1282319-A Aminobutanoic acid derivatives ONO PHARMACEUTICAL CO (JP) 2001-01-31 CN disclosed
EP-1024134-A1 AMINOBUTANOIC ACID DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-08-02 EP disclosed
WO-2000015658-A1 FACTOR VIIa INHIBITORS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2000-03-23 WO disclosed
EP-0987274-A1 Factor VIIa Inhibitors Hoechst Marion Roussel Deutschland GmbH (DE) 2000-03-22 EP 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 (5 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-20240208968-A1 ALPHA V BETA 6 AND ALPHA V BETA 1 INTEGRIN INHIBITORS AND USES THEREOF ITGB1, ITGA1, ITGAV SLC1A1 3740/4885LTA4H 666/4885CA12 2865/4885
US-20240115553-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN INJURY FABP7, PYGB, CHAT SLC1A1 1024/4885LTA4H 927/4885CA12 145/4885
US-20230123729-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASES HTT, AVPR2, AVPR1B SLC1A1 337/4885LTA4H 1747/4885CA12 2914/4885
US-20040006093-A1 Compounds which inhibit leukocyte adhesion mediated by VLA-4 VCAM1, ICAM1, CD4 SLC1A1 508/4885LTA4H 15/4885CA12 2790/4885
US-11628160-B2 Compositions and methods for treating brain injury FABP7, PYGB, CHAT SLC1A1 1024/4885LTA4H 927/4885CA12 145/4885

“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.