Arginine

Arginine

SCHEMBL4824931

CCOC(Cc1cccc(NCCCN2CCOc3ccccc32)c1)C(=O)O.N=C(N)NCCCC(N)C(=O)O

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACES1PR1S1PR4S1PR5

The experimentally established mechanism targets of Arginine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.40
PPARA Q07869 7/20 0.40
TSHR P16473 3/20 0.36
TACR2 P21452 2/20 0.34
RAB9A P51151 1/20 0.33
SIRT1 Q96EB6 1/20 0.33
HTR1A P08908 1/20 0.33
SLC6A4 P31645 1/20 0.33
HPGD P15428 1/20 0.33

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
Arginine SCHEMBL4824934 1.00 PPARG (0.40) PPARGPPARATSHRTACR2RAB9A
Arginine SCHEMBL4826319 0.93 PPARG (0.44) PPARGPPARATSHRTACR2HPGD
Arginine SCHEMBL4826312 0.93 PPARG (0.44) PPARGPPARATSHRTACR2HPGD
SCHEMBL4824935 0.91 TSHR (0.34) PPARGPPARATSHRTACR2RAB9A
Arginine SCHEMBL6681422 0.91 PPARG (0.48) PPARGPPARA
Arginine SCHEMBL4824341 0.89 PPARG (0.45) PPARGPPARATSHRHPGD
Arginine SCHEMBL4824344 0.89 PPARG (0.45) PPARGPPARATSHRHPGD
SCHEMBL1860109 0.89 PPARG (0.48) PPARGPPARATSHRHTR1ASLC6A4
Arginine SCHEMBL4825267 0.85 PPARG (0.35) PPARGPPARATACR2
Arginine SCHEMBL4823686 0.85 PPARG (0.35) PPARGPPARATACR2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7365064-B2 Benzoxazine and benzothiazine derivatives and pharmaceutical compositions containing them DR. REDDY'S LABORATORIES LIMITED (IN) 2008-04-29 US disclosed
US-20050113368-A1 Benzoxazine and benzothiazine derivatives and pharmaceutical compositions containing them DR. REDDY'S LABORATORIES LIMITED (IN) 2005-05-26 US disclosed
EP-1436268-A1 BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Dr. Reddy's Laboratories Ltd. (IN) 2004-07-14 EP disclosed
WO-2003033481-A1 BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND PARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S LABORATORIES LTD. (IN) 2003-04-24 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 (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-20050113368-A1 Benzoxazine and benzothiazine derivatives and pharmaceutical compositions containing them CYP3A5, HBZ, CYP4Z1 PPARG 86/4885PPARA 113/4885TSHR 1645/4885

“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.