Valine

Valine

SCHEMBL1933771

CC(C)C(N)C(=O)O.CO.ClC(Cl)Cl

nearest known ligand 0.79

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.79
SLC1A3 P43003 3/20 0.41
SLC1A2 P43004 3/20 0.41
SLC1A1 P43005 2/20 0.41
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.36
DPP4 P27487 2/20 0.35
FAP Q12884 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
ALDH1A1 P00352 2/20 0.35
LAP3 P28838 1/20 0.35
USP2 O75604 1/20 0.33
SLCO1B1 Q9Y6L6 1/20 0.33
ENPEP Q07075 2/20 0.32
MAPT P10636 1/20 0.32
PTGS1 P23219 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
Valine SCHEMBL6267142 0.97 SLC7A5 (0.83) SLC7A5SLC1A3SLC1A2SLC1A1LMNA
Valine SCHEMBL8850083 0.92 SLC7A5 (0.94) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL15602719 0.89 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1LMNA
Valine SCHEMBL27571970 0.89 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1LMNA
Valine SCHEMBL482773 0.89 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1LMNA
Valine SCHEMBL8516 0.89
Valine SCHEMBL41225 0.89 SLC7A5 (1.00) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL43678 0.89
Valine SCHEMBL1813972 0.89 SLC7A5 (1.00) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL288203 0.89 SLC7A5 (1.00) SLC7A5SLC1A3SLC1A2SLC1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3897153-A1 ISOLATION OF FUNGAL MELANIN AND USES IN EXTERNAL RADIATION SHIELDING AND HEAT CAPTURE The Johns Hopkins University (US) 2021-10-27 EP claimed
WO-2020132555-A1 ISOLATION OF FUNGAL MELANIN AND USES IN EXTERNAL RADIATION SHIELDING AND HEAT CAPTURE THE JOHNS HOPKINS UNIVERSITY (US) 2020-06-25 WO claimed
US-20230172903-A1 INHIBITORS OF GLUCOSYLCERAMIDE SYNTHASE GENZYME CORPORATION 2023-06-08 US disclosed
US-20210393590-A1 INHIBITORS OF GLUCOSYLCERAMIDE SYNTHASE GENZYME CORP (US) 2021-12-23 US disclosed
US-20210369672-A1 INHIBITORS OF GLUCOSYLCERAMIDE SYNTHASE GENZYME CORP (US) 2021-12-02 US disclosed
EP-3898170-A1 MELANIN BASED BIO-COMPOSITES FOR 3D PRINTING The Johns Hopkins University (US) 2021-10-27 EP disclosed
EP-3897153-A1 ISOLATION OF FUNGAL MELANIN AND USES IN EXTERNAL RADIATION SHIELDING AND HEAT CAPTURE The Johns Hopkins University (US) 2021-10-27 EP disclosed
EP-3896069-A1 PHARMACEUTICAL COMPOSITION OF THE GLUCOSYLCERAMIDE SYNTHASE INHIBITOR ELIGLUSTAT FOR THE TREATMENT GAUCHER'S DISEASE COMPRISING ADJUSTING THE INDIVIDUAL THERAPEUTICAL DOSE TO THE P450 METABOLISM OF THE PATIENT Genzyme Corporation (US) 2021-10-20 EP disclosed
EP-3599237-B1 PHARMACEUTICAL COMPOSITION OF THE GLUCOSYLCERAMIDE SYNTHASE INHIBITOR ELIGLUSTAT FOR THE TREATMENT OF GAUCHER'S DISEASE COMPRISING ADJUSTING THE INDIVIDUAL THERAPEUTICAL DOSE TO THE P450 METABOLISM OF THE PATIENT GENZYME CORP (US) 2021-03-24 EP disclosed
EP-2504332-B2 AN AMORPHOUS AND A CRYSTALLINE FORM OF GENZ 112638 HEMITARTRATE AS INHIBITOR OF GLUCOSYLCERAMIDE SYNTHASE GENZYME CORP (US) 2021-03-17 EP disclosed
US-10888547-B2 Amorphous and a crystalline form of genz 112638 hemitartrate as inhibitor of glucosylceramide synthase GENZYME CORPORATION (US) 2021-01-12 US disclosed
US-20070014842-A1 Pharmaceutical liposomal compositions ID BIOMEDICAL CORPORATION OF QUEBEC C.O.B. AS GLAXOSMITHKLINE BIOLOGICALS NORTH AMERICA (CA) 2007-01-18 US disclosed
US-20060037104-A1 Modified cottonseed oil COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION 2006-02-16 US disclosed
US-6974898-B2 Method of modifying the content of cottonseed oil COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2005-12-13 US disclosed
US-20050107597-A1 Polypeptides of pseudomonas aeruginosa ID BIOMEDICAL CORPORATION (CA) 2005-05-19 US disclosed
EP-1282709-A4 METHOD OF MODIFYING THE CONTENT OF COTTONSEED OIL COMMW SCIENT IND RES ORG (AU) 2005-01-19 EP disclosed
US-20040132652-A1 Pharmaceutical compositions SHIRE BIOCHEM INC. (CA) 2004-07-08 US disclosed
EP-1282709-A1 METHOD OF MODIFYING THE CONTENT OF COTTONSEED OIL COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2003-02-12 EP disclosed
US-20020104124-A1 Method of modifying the content of cottonseed oil COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2002-08-01 US disclosed
WO-2001079499-A1 METHOD OF MODIFYING THE CONTENT OF COTTONSEED OIL COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2001-10-25 WO 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-20210393590-A1 INHIBITORS OF GLUCOSYLCERAMIDE SYNTHASE GBA1, UGCG, GBA2 SLC7A5 951/4885SLC1A3 1628/4885SLC1A2 1816/4885
US-20230172903-A1 INHIBITORS OF GLUCOSYLCERAMIDE SYNTHASE GBA1, UGCG, GBA2 SLC7A5 833/4885SLC1A3 1620/4885SLC1A2 1795/4885
US-20210369672-A1 INHIBITORS OF GLUCOSYLCERAMIDE SYNTHASE GBA1, UGCG, GBA2 SLC7A5 833/4885SLC1A3 1620/4885SLC1A2 1795/4885
US-20070014842-A1 Pharmaceutical liposomal compositions NGLY1, PHOSPHO1, LPXN SLC7A5 2535/4885SLC1A3 3556/4885SLC1A2 4141/4885
US-10888547-B2 Amorphous and a crystalline form of genz 112638 hemitartrate as inhibitor of glucosylceramide synthase GBA1, GBA2, UGCG SLC7A5 877/4885SLC1A3 2260/4885SLC1A2 2947/4885

“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.