SCHEMBL1801469

SCHEMBL1801469

C[C@H](NC(=O)OCc1ccccc1)C(=O)Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.56
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
CTSL P07711 7/20 0.50
CTSB P07858 3/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
ALDH1A1 P00352 1/20 0.49
TP53 P04637 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CTSS P25774 1/20 0.48
CTSK P43235 1/20 0.48

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
SCHEMBL10794620 1.00 HTR2A (0.56) HTR2AMEN1KMT2ACTSLCTSB
SCHEMBL7333604 0.90 HTR2A (0.53) HTR2AMEN1KMT2ACTSLCTSB
SCHEMBL7328473 0.90 HTR2A (0.53) HTR2AMEN1KMT2ACTSLCTSB
SCHEMBL8433557 0.89 CTSL (0.55) MEN1KMT2ACTSLCTSBNPC1
SCHEMBL8433550 0.89 CTSL (0.55) MEN1KMT2ACTSLCTSBNPC1
SCHEMBL3881009 0.88 CTSL (0.62) CTSLCTSBCTSSCTSK
SCHEMBL10366989 0.88 CTSL (0.62) CTSLCTSBCTSSCTSK
SCHEMBL30404224 0.88 CTSL (0.62) CTSLCTSBCTSSCTSK
SCHEMBL11415411 0.87 CTSK (0.53) HTR2ACTSLCTSBCTSK
SCHEMBL1286216 0.87 ELANE (0.59) MEN1KMT2ACTSLCTSBNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250092088-A1 PEPTIDE COMPOUND PRODUCTION METHOD CHUBU UNIVERSITY EDUCATIONAL FOUNDATION (JP) 2025-03-20 US disclosed
WO-2023136301-A1 PEPTIDE COMPOUND PRODUCTION METHOD 学校法人中部大学 2023-07-20 WO disclosed
US-20220289660-A1 COMPOUNDS AND METHODS FOR DELIVERY OF PROSTACYCLIN ANALOGS UNITED THERAPEUTICS CORPORATION (US) 2022-09-15 US disclosed
US-11292758-B2 Compounds and methods for delivery of prostacyclin analogs UNITED THERAPEUTICS CORPORATION (US) 2022-04-05 US disclosed
US-20220024845-A1 COMPOUNDS AND METHODS FOR DELIVERY OF PROSTACYCLIN ANALOGS UNITED THERAPEUTICS CORPORATION (US) 2022-01-27 US disclosed
US-10947177-B2 Compounds and methods for delivery of prostacyclin analogs UNITED THERAPEUTICS CORPORATION (US) 2021-03-16 US disclosed
US-20200181057-A1 COMPOUNDS AND METHODS FOR DELIVERY OF PROSTACYCLIN ANALOGS UNITED THERAPEUTICS CORPORATION (US) 2020-06-11 US disclosed
US-20190345091-A1 COMPOUNDS AND METHODS FOR DELIVERY OF PROSTACYCLIN ANALOGS UNITED THERAPEUTICS CORPORATION (US) 2019-11-14 US disclosed
US-20180141891-A1 COMPOUNDS AND METHODS FOR DELIVERY OF PROSTACYCLIN ANALOGS UNITED THERAPEUTICS CORPORATION (US) 2018-05-24 US disclosed
EP-2792353-B1 Polymorph of Treprostinil diethanolamine salt UNITED THERAPEUTICS CORP (US) 2018-02-28 EP disclosed
US-4985361-A GENETIC ENGINEERING SANKYO COMPANY, LIMITED (JP) 1991-01-15 US disclosed
EP-0198645-B1 HUMAN PANCREATIC ELASTASE SANKYO COMPANY LIMITED (JP) 1990-11-22 EP disclosed
EP-0142231-B1 PROCESS FOR PRODUCING SEQUENTIAL POLYAMINO ACID RESIN NITTO BOSEKI CO., LTD. (JP) 1987-11-11 EP disclosed
EP-0198645-A1 Human pancreatic elastase SANKYO COMPANY LIMITED (JP) 1986-10-22 EP disclosed
US-4594409-A Polycondensation of a peptide active ester salt NITTO BOSEKI CO., LTD. (JP) 1986-06-10 US disclosed
EP-0142231-A1 Process for producing sequential polyamino acid resin NITTO BOSEKI CO., LTD. (JP) 1985-05-22 EP disclosed
US-4510241-A BASED ON AXCTIVATING A PROCLOTTIN ENZYME FROM AN AMOEBA FROM HORSE MALLINCKRODT, INC. (US) 1985-04-09 US disclosed
EP-0094554-A1 Test for esterase activity in a liquid sample MILES LABORATORIES, INC. (US) 1983-11-23 EP disclosed
US-4406832-A Peptide-type substrates useful in the quantitative determination of endotoxin MALLINCKRODT, INC. (US) 1983-09-27 US disclosed
US-4237046-A VASODILATION BOARD OF REGENTS THE, THE UNIVERSITY OF TEXAS SYSTEM 1980-12-02 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 (8 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-20220289660-A1 COMPOUNDS AND METHODS FOR DELIVERY OF PROSTACYCLIN ANALOGS PTGIR, PTGIS, PGF HTR2A 940/4885MEN1 3275/4885KMT2A 4674/4885
US-20220024845-A1 COMPOUNDS AND METHODS FOR DELIVERY OF PROSTACYCLIN ANALOGS PTGIR, PTGIS, PGF HTR2A 940/4885MEN1 3275/4885KMT2A 4674/4885
US-10947177-B2 Compounds and methods for delivery of prostacyclin analogs PTGIR, PTGIS, PGF HTR2A 1063/4885MEN1 3087/4885KMT2A 4651/4885
US-20250092088-A1 PEPTIDE COMPOUND PRODUCTION METHOD VIP, NPPA, HM13 HTR2A 3844/4885MEN1 464/4885KMT2A 3104/4885
US-11292758-B2 Compounds and methods for delivery of prostacyclin analogs PTGIR, PTGIS, PGF HTR2A 1063/4885MEN1 3087/4885KMT2A 4651/4885
US-20190345091-A1 COMPOUNDS AND METHODS FOR DELIVERY OF PROSTACYCLIN ANALOGS PTGIR, PTGIS, PGF HTR2A 1063/4885MEN1 3087/4885KMT2A 4651/4885
US-20180141891-A1 COMPOUNDS AND METHODS FOR DELIVERY OF PROSTACYCLIN ANALOGS PTGIR, PTGIS, PGF HTR2A 1063/4885MEN1 3087/4885KMT2A 4651/4885
US-20200181057-A1 COMPOUNDS AND METHODS FOR DELIVERY OF PROSTACYCLIN ANALOGS PTGIR, PTGIS, PGF HTR2A 1063/4885MEN1 3087/4885KMT2A 4651/4885

“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.