SCHEMBL547491

SCHEMBL547491

CC(C)C[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)Nc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDF Q9HBH1 1/20 0.61
▸ SSTR3 P32745 1/20 0.54
▸ MMP3 P08254 3/20 0.43
▸ MMP1 P03956 1/20 0.41
▸ MMP9 P14780 1/20 0.41
▸ MMP2 P08253 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ LMNA P02545 4/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ MAPT P10636 3/20 0.40
▸ GLA P06280 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ OPRK1 P41145 4/20 0.39
▸ OPRM1 P35372 2/20 0.39
▸ ERAP2 Q6P179 2/20 0.39
▸ KLKB1 P03952 1/20 0.39
▸ ERAP1 Q9NZ08 1/20 0.39
▸ LNPEP Q9UIQ6 1/20 0.39

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
SCHEMBL386663 1.00 PDF (0.61) PDFSSTR3MMP3MMP1MMP9
SCHEMBL27750016 1.00 PDF (0.61) PDFSSTR3MMP3MMP1MMP9
Hydrochloric Acid SCHEMBL8853773 0.99 PDF (0.60) PDFSSTR3MMP3MMP1MMP9
Hydrochloric Acid SCHEMBL3481900 0.99 PDF (0.60) PDFSSTR3MMP3MMP1MMP9
Hydrochloric Acid SCHEMBL3482618 0.99 PDF (0.60) PDFSSTR3MMP3MMP1MMP9
SCHEMBL8000347 0.94 PDF (0.67) PDFSSTR3MMP2SMN1; SMN2LMNA
SCHEMBL27695845 0.90 PDF (0.48) PDFMMP3MMP1SMN1; SMN2LMNA
SCHEMBL27695847 0.90 PDF (0.48) PDFMMP3MMP1SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL27484221 0.89 PDF (0.47) PDFMMP3MMP1SMN1; SMN2LMNA
SCHEMBL5318843 0.88 PDF (0.65) PDFSSTR3MMP3MMP1MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4740954-A2 COMPOSITIONS AND METHODS FOR TREATMENT OF NETHERTON SYNDROME WITH LEKTI EXPRESSING RECOMBINANT MICROBES AZITRA, INC. (US) 2026-05-13 — — EP disclosed
EP-3638369-B1 COMPOSITIONS AND METHODS FOR TREATMENT OF NETHERTON SYNDROME WITH LEKTI EXPRESSING RECOMBINANT MICROBES AZITRA INC (US) 2026-04-29 — — EP disclosed
US-12606610-B2 Compositions and methods for treatment of Netherton Syndrome with LEKTI expressing recombinant microbes AZITRA INC (US) 2026-04-21 — — US disclosed
US-20240218049-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF NETHERTON SYNDROME WITH LEKTI EXPRESSING RECOMBINANT MICROBES AZITRA INC (US) 2024-07-04 — — US disclosed
US-11773154-B2 Compositions and methods for treatment of Netherton Syndrome with LEKTI expressing recombinant microbes AZITRA INC (US) 2023-10-03 — — US disclosed
WO-2022272132-A2 COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL INFECTION AZITRA INC (US) 2022-12-29 — — WO disclosed
EP-4055040-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF CANCER WITH LEKTI AZITRA, INC. (US) 2022-09-14 — — EP disclosed
EP-4054713-A1 COMPOSITIONS AND METHODS FOR TREATMENT OR PREVENTION OF SKIN DISEASES AND DISORDERS WITH LEKTI AZITRA, INC. (US) 2022-09-14 — — EP disclosed
WO-2020240446-A1 MEDICAL DEVICES WITH REDUCED THROMBOGENICITY Heart Research Institute Ltd. (AU) 2020-12-03 — — WO disclosed
EP-2508611-B1 Process for production of triprenyl phenol compounds TMS CO LTD (JP) 2019-05-08 — — EP disclosed
WO-1996024849-A1 DIOXETANE COMPOUNDS FOR THE CHEMILUMINESCENT DETECTION OF PROTEASES, METHODS OF USE AND KITS THEREFORE TROPIX, INC. (US) 1996-08-15 — — WO disclosed
EP-0692968-A1 UROKINASE PLASMINOGEN ACTIVATOR FRAGMENTS THE GENERAL HOSPITAL CORPORATION (US) 1996-01-24 — — EP disclosed
WO-1995029189-A1 FACTOR Xa INHIBITORS SELECTIDE CORPORATION (US) 1995-11-02 — — WO disclosed
WO-1994022464-A1 UROKINASE PLASMINOGEN ACTIVATOR FRAGMENTS THE GENERAL HOSPITAL CORPORATION (US) 1994-10-13 — — WO disclosed
EP-0498883-A4 3-SUBSTITUTED AND 3,3-DISUBSTITUTED 4-OXORETINOIC ACIDS AND THEIR ESTERS — 1993-03-10 — — EP disclosed
EP-0498883-A1 3-SUBSTITUTED AND 3,3-DISUBSTITUTED 4-OXORETINOIC ACIDS AND THEIR ESTERS SOUTHERN RESEARCH INSTITUTE (US) 1992-08-19 — — EP disclosed
WO-1992004432-A1 3-SUBSTITUTED AND 3,3-DISUBSTITUTED 4-OXORETINOIC ACIDS AND THEIR ESTERS SOUTHERN RESEARCH INSTITUTE (US) 1992-03-19 — — WO disclosed
EP-0332678-A4 MICRO-SIZE FIBRINOLYTIC PLASMIN. UNIV NORTHWESTERN (US) 1990-06-27 — — EP disclosed
US-4851346-A PLASMIOGEN ACTIVATOR; ANTITUMOR AGENT MILES INC. (US) 1989-07-25 — — US disclosed
WO-1989001336-A1 MICRO-SIZE FIBRINOLYTIC PLASMIN NORTHWESTERN UNIVERSITY (US) 1989-02-23 — — 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-12606610-B2 Compositions and methods for treatment of Netherton Syndrome with LEKTI expressing recombinant microbes CUTA, TMPRSS11D, KLK5 PDF 2001/4885SSTR3 3918/4885MMP3 125/4885

“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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