SCHEMBL623369

SCHEMBL623369

CNCCCC[C@@H](N)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.57
ARG2 P78540 4/20 0.52
ARG1 P05089 3/20 0.52
NOS2 P35228 5/20 0.50
NOS1 P29475 4/20 0.50
NOS3 P29474 3/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
TSHR P16473 1/20 0.50
BLM P54132 1/20 0.49
DDAH1 O94760 1/20 0.47
MEN1 O00255 1/20 0.47
CYP2C19 P33261 1/20 0.47
KMT2A Q03164 1/20 0.47
OTC P00480 1/20 0.46

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
SCHEMBL64149 1.00 GSR (0.57) GSRARG2ARG1NOS2NOS1
SCHEMBL432790 1.00 GSR (0.57) GSRARG2ARG1NOS2NOS1
SCHEMBL6369985 0.98 GSR (0.55) GSRARG2ARG1NOS2NOS1
SCHEMBL28449339 0.98 GSR (0.55) GSRARG2ARG1NOS2NOS1
SCHEMBL25670261 0.98 GSR (0.55) GSRARG2ARG1NOS2NOS1
Hydrochloric Acid SCHEMBL5971277 0.98 GSR (0.55) GSRARG2ARG1NOS2NOS1
Hydrochloric Acid SCHEMBL8919761 0.98 GSR (0.55) GSRARG2ARG1NOS2NOS1
Hydrochloric Acid SCHEMBL27243097 0.98 GSR (0.55) GSRARG2ARG1NOS2NOS1
SCHEMBL3438660 0.94 GSR (0.54) GSRARG2ARG1NOS2NOS1
SCHEMBL31688818 0.94 GSR (0.54) GSRARG2ARG1NOS2NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 US claimed
CN-116559343-A Screening and application of tuberculosis urine metabolic markers 首都医科大学附属北京胸科医院 2023-08-08 CN claimed
WO-2023089542-A1 PEPTIDES AND USES THEREOF PreveCeutical Medical Inc. (CA) 2023-05-25 WO claimed
EP-4175970-A1 PEPTIDES AND USES THEREOF Preveceutical Medical Inc. (CA) 2023-05-10 EP claimed
WO-2022149610-A1 NOVEL GUANIDINE DERIVATIVE AND METHOD FOR PRODUCING SAME ペプチドリーム株式会社 2022-07-14 WO claimed
WO-2022000043-A1 PEPTIDES AND USES THEREOF PreveCeutical Medical Inc. (CA) 2022-01-06 WO claimed
CN-113769108-A Conjugates of cysteine engineered antibodies 伊缪诺金公司 2021-12-10 CN claimed
US-9796766-B2 Potent and selective inhibitors of NAV1.3 and NAV1.7 AMGEN INC. (US) 2017-10-24 US claimed
US-20160304570-A1 POTENT AND SELECTIVE INHIBITORS OF NAV1.3 AND NAV1.7 AMGEN INC. (US) 2016-10-20 US claimed
US-9340590-B2 Potent and selective inhibitors of NaV1.3 and NaV1.7 AMGEN INC. (US) 2016-05-17 US claimed
WO-2014134457-A2 CONJUGATES COMPRISING CELL-BINDING AGENTS AND CYTOTOXIC AGENTS IMMUNOGEN, INC. (US) 2014-09-04 WO claimed
US-20140073577-A1 POTENT AND SELECTIVE INHIBITORS OF NAV1.3 AND NAV1.7 AMGEN INC. (US) 2014-03-13 US claimed
EP-2686340-A2 POTENT AND SELECTIVE INHIBITORS OF NAV1.3 AND NAV1.7 Amgen Inc. (US) 2014-01-22 EP claimed
WO-2013172954-A1 PEPTIDE AND PEPTIDOMIMETIC INHIBITORS RA PHARMACEUTICALS, INC (US) 2013-11-21 WO claimed
WO-2012125973-A2 POTENT AND SELECTIVE INHIBITORS OF NAV1.3 AND NAV1.7 AMGEN INC. (US) 2012-09-20 WO claimed
US-20100240070-A1 Nonseparation Assay Methods Using Peroxide Generating Enzymes BECKMAN COULTER, INC. (US) 2010-09-23 US claimed
WO-2006108686-A2 BNP AGONISTS AIC (BE) 2006-10-19 WO claimed
EP-0920504-B1 CLASS E VOLTAGE-GATED CALCIUM CHANNEL ANTAGONIST AND METHODS ELAN PHARM INC (US) 2005-12-14 EP claimed
EP-1307217-A2 VIP-RELATED PEPTIDES FOR THE TREATMENT OF SKIN DISORDERS YEDA RESEARCH & DEVELOPMENT COMPANY, LTD. (IL) 2003-05-07 EP claimed
WO-2001093889-A2 VIP-RELATED PEPTIDES FOR THE TREATMENT OF SKIN DISORDERS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2001-12-13 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20140073577-A1 POTENT AND SELECTIVE INHIBITORS OF NAV1.3 AND NAV1.7 SCN7A, SCN3A, SCN9A GSR 4637/4885ARG2 4496/4885ARG1 4225/4885
US-20240400499-A1 NOVEL AMINO ACID DERIVATIVES BCAT1, BCAT2, PELP1 GSR 4728/4885ARG2 619/4885ARG1 472/4885
US-20160304570-A1 POTENT AND SELECTIVE INHIBITORS OF NAV1.3 AND NAV1.7 SCN7A, SCN3A, SCN9A GSR 4637/4885ARG2 4496/4885ARG1 4225/4885

“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.