Nitroarginine

Nitroarginine

SCHEMBL12556124

N/C(=N\[N+](=O)[O-])NCCCC(N)C(=O)O

nearest known ligand 0.53

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Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DDAH1 O94760 3/20 0.53
▸ NOS1 P29475 6/20 0.50
▸ OTC P00480 1/20 0.47
▸ NOS2 P35228 5/20 0.44
▸ NOS3 P29474 4/20 0.44
▸ CYP2C19 P33261 2/20 0.42
▸ CYP1A2 P05177 2/20 0.42
▸ TSHR P16473 2/20 0.42
▸ GLA P06280 1/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ APEX1 P27695 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ CYP3A4 P08684 1/20 0.40
▸ GSR P00390 1/20 0.40

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
Nitroarginine SCHEMBL14220319 1.00 DDAH1 (0.53) DDAH1NOS1OTCNOS2NOS3
Nitroarginine SCHEMBL8527851 1.00 DDAH1 (0.53) DDAH1NOS1OTCNOS2NOS3
Nitroarginine SCHEMBL8527873 1.00 DDAH1 (0.53) DDAH1NOS1OTCNOS2NOS3
Nitroarginine SCHEMBL6054201 0.94 OTC (0.52) DDAH1NOS1OTCNOS2NOS3
L-Name SCHEMBL29362113 0.84 NOS1 (0.41) DDAH1NOS1OTCTSHR
L-Name SCHEMBL5966636 0.84 NOS1 (0.41) DDAH1NOS1OTCTSHR
SCHEMBL12556111 0.84 NOS1 (0.46) DDAH1NOS1OTCNOS2NOS3
Hydrochloric Acid SCHEMBL7365158 0.83 DDAH1 (0.38) DDAH1NOS1OTCNOS2NOS3
SCHEMBL14350781 0.83 NOS1 (0.40) DDAH1NOS1OTCNOS2NOS3
SCHEMBL12237928 0.81 NOS1 (0.36) DDAH1NOS1NOS3MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2024323-B1 SALTS OF TRIMEBUTINE AND N-DESMETHYL TRIMEBUTINE GICARE PHARMA INC (CA) 2013-03-27 — — EP disclosed
US-20110144188-A1 SALTS OF TRIMEBUTINE AND N-DESMETHYL TRIMEBUTINE ANTIBE THERAPEUTICS INC. (CA) 2011-06-16 — — US disclosed
US-20110144188-A1 SALTS OF TRIMEBUTINE AND N-DESMETHYL TRIMEBUTINE ANTIBE THERAPEUTICS INC. (CA) 2011-06-16 — — US disclosed
US-7666907-B2 Salts of trimebutine and N-desmethyl trimebutine ANTIBE THERAPEUTICS INC. (CA) 2010-02-23 — — US disclosed
US-7666907-B2 Salts of trimebutine and N-desmethyl trimebutine ANTIBE THERAPEUTICS INC. (CA) 2010-02-23 — — US disclosed
WO-2007140611-A1 SALTS OF TRIMEBUTINE AND N-DESMETHYL TRIMEBUTINE ANTIBE THERAPEUTICS INC. (CA) 2007-12-13 — — WO disclosed
US-20070275905-A1 SALTS OF TRIMEBUTINE AND N-DESMETHYL TRIMEBUTINE ANTIBE THERAPEUTICS INC. (CA) 2007-11-29 — — US disclosed
US-20070275905-A1 SALTS OF TRIMEBUTINE AND N-DESMETHYL TRIMEBUTINE ANTIBE THERAPEUTICS INC. (CA) 2007-11-29 — — US 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 (2 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-20110144188-A1 SALTS OF TRIMEBUTINE AND N-DESMETHYL TRIMEBUTINE SI, VIP, TRIM59 DDAH1 823/4885NOS1 1259/4885OTC 3312/4885
US-20070275905-A1 SALTS OF TRIMEBUTINE AND N-DESMETHYL TRIMEBUTINE SI, VIP, TRIM59 DDAH1 823/4885NOS1 1259/4885OTC 3312/4885

“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.

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