SCHEMBL6476819

SCHEMBL6476819

NCCCC[C@@H](NC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 4/20 0.66
ITGA2B P08514 4/20 0.66
ECE1 P42892 1/20 0.66
CPB1 P15086 1/20 0.62
CPB2 Q96IY4 1/20 0.62
FOLH1 Q04609 2/20 0.59
ACE P12821 1/20 0.59
SIRT2 Q8IXJ6 3/20 0.58
SIRT1 Q96EB6 3/20 0.58
SIRT3 Q9NTG7 2/20 0.58
DPP4 P27487 2/20 0.58
PRSS1 P07477 2/20 0.57
PRSS2 P07478 2/20 0.57
PRSS3 P35030 2/20 0.57
TPSAB1 Q15661 2/20 0.57
TLR2 O60603 2/20 0.56
DPP8 Q6V1X1 1/20 0.55

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
SCHEMBL287474 1.00 ITGB3 (0.66) ITGB3ITGA2BECE1CPB1CPB2
SCHEMBL15968143 1.00 ITGB3 (0.66) ITGB3ITGA2BECE1CPB1CPB2
SCHEMBL287475 1.00 ITGB3 (0.66) ITGB3ITGA2BECE1CPB1CPB2
Hydrochloric Acid SCHEMBL4994643 0.99 ITGB3 (0.65) ITGB3ITGA2BECE1CPB1CPB2
SCHEMBL29733071 0.99 ITGB3 (0.65) ITGB3ITGA2BECE1CPB1CPB2
Hydrochloric Acid SCHEMBL11310715 0.99 ITGB3 (0.65) ITGB3ITGA2BECE1CPB1CPB2
Hydrochloric Acid SCHEMBL21219335 0.99 ITGB3 (0.65) ITGB3ITGA2BECE1CPB1CPB2
Monoethanolamine SCHEMBL9496843 0.96 ITGB3 (0.62) ITGB3ITGA2BECE1CPB1CPB2
Glycine SCHEMBL28708677 0.96 ITGB3 (0.62) ITGB3ITGA2BECE1CPB1CPB2
SCHEMBL2367228 0.96 ITGB3 (0.64) ITGB3ITGA2BECE1CPB1CPB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3246048-B1 BI-FUNCTIONAL CO-POLYMER USE FOR OPHTHALMIC APPLICATIONS CALM WATER THERAPEUTICS LLC (US) 2024-04-03 EP claimed
CN-115090225-A Novel efficient aldehyde-removing transparent gel and preparation method thereof 重庆中科力泰高分子材料股份有限公司 2022-09-23 CN claimed
US-20260062446-A1 SCALABLE SYNTHESIS OF ANABAENOPEPTINS WAYNE STATE UNIVERSITY (US) 2026-03-05 US disclosed
US-20250241943-A1 BI-FUNCTIONAL CO-POLYMER USE FOR OPHTHALMIC AND OTHER TOPICAL AND LOCAL APPLICATIONS CALM WATER THERAPEUTICS LLC 2025-07-31 US disclosed
CN-113527217-B Diketopiperazine compound and application thereof 上海惠永药物研究有限公司 2025-05-23 CN disclosed
CN-119875130-A Polyethylene glycol modified polylysine, preparation method thereof, nano vaccine and application 中国科学院长春应用化学研究所 2025-04-25 CN disclosed
CN-113527216-B Preparation method of diketopiperazine compound, intermediate thereof and preparation method thereof 上海惠永药物研究有限公司 2025-03-21 CN disclosed
EP-4426353-A2 METHODS FOR USING BIOADHESIVE AND STERIC INTERACTIONS OF COPOLYMERS TO MINIMIZE ADVERSE EFFECTS Calm Water Therapeutics LLC (US) 2024-09-11 EP disclosed
EP-4425181-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE Bertis Inc (KR) 2024-09-04 EP disclosed
WO-2024177424-A1 NOVEL IONIZABLE LIPID AND LIPID NANOPARTICLE CONTAINING SAME 에스티팜 주식회사 2024-08-29 WO disclosed
EP-3246048-B1 BI-FUNCTIONAL CO-POLYMER USE FOR OPHTHALMIC APPLICATIONS CALM WATER THERAPEUTICS LLC (US) 2024-04-03 EP disclosed
WO-2001014316-A1 SUBSTITUTED CHIRAL ALLOSTERIC HEMOGLOBIN MODIFIERS VIRGINIA COMMONWEALTH UNIVERSITY (US) 2001-03-01 WO disclosed
US-5885816-A OPTICALLY RESOLVING A RACEMIC MIXTURE OF AMINO ACID DERIVATIVES, COMPRISING USING A NONSPECIFIC CATALYTIC ANTIBODY WHICH ENANTIOSELECTIVELY HYDROLIZES VARIOUS AMINO ACID ESTER DERIVATIVES PROTEIN ENGINEERING RESEARCH INSTITUTE (JP) 1999-03-23 US disclosed
EP-0765940-A1 CATALYTIC ANTIBODY WHICH HYDROLYZES AMINO ACID ESTER DERIVATIVE ENANTIOSELECTIVELY PROTEIN ENGINEERING RESEARCH INSTITUTE (JP) 1997-04-02 EP disclosed
EP-0680469-A1 AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME Dr. Karl Thomae GmbH (DE) 1995-11-08 EP disclosed
WO-1994017035-A1 AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME DR. KARL THOMAE GMBH (DE) 1994-08-04 WO disclosed
EP-0097031-B1 NONAPEPTIDE AND DECAPEPTIDE ANALOGS OF LHRH USEFUL AS LHRH ANTAGONISTS, THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM SYNTEX (U.S.A.) INC. (US) 1988-09-21 EP disclosed
EP-0145258-B1 NONAPEPTIDE AND DECAPEPTIDE ANALOGS OF LHRH, USEFUL AS LHRH AGONISTS, AND PROCESSES FOR THEIR PREPARATION SYNTEX (U.S.A.) INC. (US) 1987-04-15 EP disclosed
EP-0145258-A1 Nonapeptide and decapeptide analogs of LHRH, useful as LHRH agonists, and processes for their preparation SYNTEX (U.S.A.) INC. (US) 1985-06-19 EP disclosed
EP-0097031-A2 Nonapeptide and decapeptide analogs of LHRH useful as LHRH antagonists, their preparation and compositions containing them SYNTEX (U.S.A.) INC. (US) 1983-12-28 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-20260062446-A1 SCALABLE SYNTHESIS OF ANABAENOPEPTINS AQP1, PTMS, CHAMP1 ITGB3 4831/4885ITGA2B 4813/4885ECE1 1637/4885

“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.