SCHEMBL1196063

SCHEMBL1196063

CCO[C@@H](C(=O)O)[C@@H](OCC)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.40
SLC1A3 P43003 6/20 0.39
SLC1A2 P43004 6/20 0.39
SLC1A1 P43005 6/20 0.39
LMNA P02545 2/20 0.38
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP3 P08254 1/20 0.38
MMP9 P14780 1/20 0.38
MMP13 P45452 1/20 0.38
CHRM1 P11229 1/20 0.38
AKR1A1 P14550 1/20 0.38
CHRM3 P20309 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
ADRA1A P35348 1/20 0.38
HRH1 P35367 1/20 0.38
DRD3 P35462 1/20 0.38
SLC6A3 Q01959 1/20 0.38
HDAC1 Q13547 1/20 0.38

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
SCHEMBL1160265 1.00 THRB (0.40) THRBSLC1A3SLC1A2SLC1A1LMNA
SCHEMBL387178 1.00 THRB (0.40) THRBSLC1A3SLC1A2SLC1A1LMNA
Glycolic Acid SCHEMBL28099037 0.90 FFAR3 (0.35) THRBSLC1A3SLC1A2SLC1A1LMNA
Glycine SCHEMBL29869337 0.88 GLRA1 (0.46) THRBSLC1A3SLC1A2SLC1A1MMP1
SCHEMBL26940409 0.87 MMP1 (0.48) THRBSLC1A3SLC1A2SLC1A1LMNA
SCHEMBL9628984 0.87 MMP1 (0.48) THRBSLC1A3SLC1A2SLC1A1LMNA
SCHEMBL7069046 0.85 LMNA (0.38) THRBSLC1A3SLC1A2SLC1A1LMNA
SCHEMBL2963336 0.85 TSHR (0.41) THRBSLC1A3SLC1A2SLC1A1LMNA
SCHEMBL11382908 0.83 TDP1 (0.36) THRBSLC1A3SLC1A2SLC1A1LMNA
SCHEMBL2985403 0.83 MMP1 (0.32) THRBSLC1A3SLC1A2SLC1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190010284-A1 DUAL METAL CYANIDE CATALYST, PREPARATION METHOD THEREFOR, AND METHOD FOR PREPARING POLYCARBONATE POLYOL BY USING CATALYST POSCO CO., LTD (KR) 2019-01-10 US claimed
EP-1802584-B1 PROCESSES FOR THE PREPARATION OF SUBSTITUTED SULFOXIDES RANBAXY LAB LTD (IN) 2009-09-16 EP claimed
EP-1539768-A2 A NEW PROCESS FOR THE PREPARATION OF EPOTHILONE DERIVATIVES, NEW EPOTHILONE DERIVATIVES AS WELL AS NEW INTERMEDIATE PRODUCTS FOR THE PROCESS AND THE METHODS OF PREPARING SAME Novartis AG (CH) 2005-06-15 EP claimed
WO-2004024735-A2 A NEW PROCESS FOR THE PREPARATION OF EPOTHILONE DERIVATIVES, NEW EPOTHILONE DERIVATIVES AS WELL AS NEW INTERMEDIATE PRODUCTS FOR THE PROCESS AND THE METHODS OF PREPARING SAME NOVARTIS AG (CH) 2004-03-25 WO claimed
EP-0693704-B1 Semi-organic crystals for nonlinear optical devices ROCKWELL INTERNATIONAL CORP (US) 2002-08-28 EP claimed
EP-0772646-B1 FLUOROELASTOMER MOULDING PROCESS DU PONT (US) 2000-03-01 EP claimed
EP-0772646-A4 FLUOROELASTOMER MOULDING PROCESS DU PONT (US) 1997-12-10 EP claimed
EP-0772646-A1 FLUOROELASTOMER MOULDING PROCESS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1997-05-14 EP claimed
WO-1996001870-A1 FLUOROELASTOMER MOULDING PROCESS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-01-25 WO claimed
EP-0693704-A1 Semi-organic crystals for nonlinear optical devices ROCKWELL INTERNATIONAL CORPORATION (US) 1996-01-24 EP claimed
EP-0691371-A1 Fluoroelastomer compositions DU PONT DE NEMOURS INTERNATIONAL S.A. (CH) 1996-01-10 EP claimed
EP-0255379-B1 Optically active alcohols, process for producing the same, and process for resolving the same NISSAN CHEMICAL IND LTD (JP) 1995-11-15 EP claimed
US-10745404-B2 Process for the synthesis of E1 activating enzyme inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2020-08-18 US disclosed
US-10619006-B2 Dual metal cyanide catalyst, preparation method therefor, and method for preparing polycarbonate polyol by using catalyst POSCO (KR) 2020-04-14 US disclosed
EP-2540726-B1 Intermediates for the synthesis of E1 activity activating enzyme inhibitors MILLENNIUM PHARM INC (US) 2019-10-09 EP disclosed
EP-2546256-B1 Process for the synthesis of E1 activating enzyme inhibitors MILLENNIUM PHARM INC (US) 2019-10-09 EP disclosed
EP-0241235-A2 Process for the preparation of homoallyl alcohols ICI AUSTRALIA LIMITED (AU) 1987-10-14 EP disclosed
US-4668814-A ANTIULCER AGENTS, ANTIASHMATICS, ANTICOAGULANTS THE UPJOHN COMPANY (US) 1987-05-26 US disclosed
US-4552695-A Process for production of diltiazem hydrochloride SHIONOGI & CO., LTD. (JP) 1985-11-12 US disclosed
EP-0159784-A1 Carbacyclin analogues THE UPJOHN COMPANY (US) 1985-10-30 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 (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-10745404-B2 Process for the synthesis of E1 activating enzyme inhibitors SULT1E1, SULT1A1, STS THRB 3471/4885SLC1A3 1693/4885SLC1A2 1758/4885

“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.