SCHEMBL1085701

SCHEMBL1085701

COC(OC)C(C)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.40
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
SLC7A5 Q01650 1/20 0.33
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
KMT2A Q03164 1/20 0.30
ENPEP Q07075 2/20 0.30

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
SCHEMBL9730154 0.77
SCHEMBL5462613 0.77
SCHEMBL12158332 0.77
SCHEMBL26940423 0.77
SCHEMBL846734 0.77
SCHEMBL12818554 0.77 CYP3A4 (0.35)
SCHEMBL31191911 0.74 SLC1A3 (0.32) SLC1A3SLC1A2SLC1A1
Ammonia Solution, Strong SCHEMBL27753053 0.74 TP53 (0.38) TP53SLC1A3SLC1A2SLC1A1SLC7A5
SCHEMBL2034471 0.74 SMN1; SMN2 (0.44) KMT2A
SCHEMBL17010828 0.74 SLC1A3 (0.54) TP53SLC1A3SLC1A2SLC1A1SLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3860712-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN Vertex Pharmaceuticals Incorporated (US) 2021-08-11 EP claimed
US-20210179587-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN VERTEX PHARMACEUTICALS INCORPORATED 2021-06-17 US claimed
WO-2020081257-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN VERTEX PHARMACEUTICALS INCORPORATED (US) 2020-04-23 WO claimed
CN-107602565-B Synthesis method of 2-amino-6-methyl- [1, 2, 4] -triazolo [1, 5-a ] pyrimidine-5-ketone 浙江大学 2020-03-31 CN claimed
US-20030236397-A1 Process for preparing beta-L-2'deoxy-thymidine BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-12-25 US claimed
WO-2003087118-A2 METHOD FOR PRODUCING BETA-L-2'DEOXY-THYMIDINE BOEHRINGER INGELHEIM PHARMA GMBH & CO.KG (DE) 2003-10-23 WO claimed
US-20250153438-A1 METHOD FOR SEPARATING POLYMER ELEMENTS, WHICH WERE PRODUCED BY AN ADDITIVE MANUFACTURING METHOD, BY MEANS OF GRANULAR MEDIA 84J GmbH & Co. KG (DE) 2025-05-15 US disclosed
US-20240287063-A1 METHIONINE ADENOSYLTRANSFERASE 2A INHIBITOR NANJING CHIA TAI TIANQING PHARMACEUTICAL CO., LTD. (CN) 2024-08-29 US disclosed
CN-117412967-A Methionine adenosine transferase 2A inhibitors 南京正大天晴制药有限公司 2024-01-16 CN disclosed
US-20230265080-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN VERTEX PHARMA (US) 2023-08-24 US disclosed
US-11623924-B2 Modulators of alpha-1 antitrypsin VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-04-11 US disclosed
EP-3860712-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN Vertex Pharmaceuticals Incorporated (US) 2021-08-11 EP disclosed
EP-3650442-B1 METHOD FOR THE PREPARATION OF DIFLUOROMETHYL PYRAZOLE CARBOXYLIC ALKYL ESTER AND ITS ACID LONZA SOLUTIONS AG (CH) 2021-06-30 EP disclosed
EP-2055694-A1 Method for manufacturing alkyl-3-alkoxyprop-2-enoates LONZA AG (CH) 2009-05-06 EP disclosed
WO-2008073311-A2 SUBSTITUTED DIAZEPINE SULFONAMIDES AS BOMBESIN RECEPTOR SUBTYPE-3 MODULATORS MERCK & CO., INC. (US) 2008-06-19 WO disclosed
US-20030236397-A1 Process for preparing beta-L-2'deoxy-thymidine BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-12-25 US disclosed
WO-2003087118-A2 METHOD FOR PRODUCING BETA-L-2'DEOXY-THYMIDINE BOEHRINGER INGELHEIM PHARMA GMBH & CO.KG (DE) 2003-10-23 WO disclosed
US-6339090-B1 FOR THERAPY OF BENIGN PROSTATIC HYPERPLASIA MERCK & CO., INC. 2002-01-15 US disclosed
WO-2000006565-A1 ALPHA 1a ADRENERGIC RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2000-02-10 WO disclosed
EP-0302359-A2 Positive photo-sensitive compositions HOECHST AKTIENGESELLSCHAFT (DE) 1989-02-08 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-20240287063-A1 METHIONINE ADENOSYLTRANSFERASE 2A INHIBITOR MAT2A, MAT2B, MAT1A TP53 3417/4885SLC1A3 441/4885SLC1A2 164/4885
US-20030236397-A1 Process for preparing beta-L-2'deoxy-thymidine TYMP, TYMS, DERA TP53 2958/4885SLC1A3 2269/4885SLC1A2 1583/4885
US-11623924-B2 Modulators of alpha-1 antitrypsin SERPINA2, SERPINA3, SERPINB1 TP53 4492/4885SLC1A3 4281/4885SLC1A2 4521/4885
US-20210179587-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN SERPINA2, SERPINA3, SERPINB1 TP53 4492/4885SLC1A3 4281/4885SLC1A2 4521/4885
US-20230265080-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN SERPINA2, SERPINA3, SERPINB1 TP53 4492/4885SLC1A3 4281/4885SLC1A2 4521/4885

“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.