SCHEMBL6049428

SCHEMBL6049428

N=C(N)NCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NTSR2 O95665 6/20 0.48
NTSR1 P30989 6/20 0.48
SORT1 Q99523 6/20 0.48
OPRM1 P35372 3/20 0.45
NPFFR1 Q9GZQ6 2/20 0.45
NPFFR2 Q9Y5X5 2/20 0.45
OPRD1 P41143 1/20 0.45

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
SCHEMBL7586649 0.88 OPRM1 (0.47) OPRM1NPFFR1NPFFR2OPRD1
SCHEMBL30561151 0.88 OPRM1 (0.47) OPRM1NPFFR1NPFFR2OPRD1
SCHEMBL497331 0.86 FKBP4 (0.43) OPRM1NPFFR1NPFFR2OPRD1
SCHEMBL29442961 0.86 OPRM1 (0.45) OPRM1NPFFR1NPFFR2OPRD1
Hydrochloric Acid SCHEMBL29793967 0.85 OPRM1 (0.45) OPRM1NPFFR1NPFFR2OPRD1
SCHEMBL30038002 0.83 NPY4R (0.59) OPRM1NPFFR1NPFFR2OPRD1
SCHEMBL8502170 0.83 OPRM1 (0.42) OPRM1
SCHEMBL32664435 0.82 NTSR2 (0.58) NTSR2NTSR1SORT1OPRM1NPFFR1
SCHEMBL5704652 0.82 FKBP4 (0.48) OPRM1NPFFR1NPFFR2OPRD1
SCHEMBL5835132 0.82 FKBP4 (0.41) NTSR2NTSR1SORT1OPRM1

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 22 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
CN-114805365-B Factor XIA new macrocycles carrying non-aromatic P2' groups 百时美施贵宝公司 2024-07-23 CN 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
CN-116987080-A Macrocyclic compounds with heterocyclic P2' groups as factor XIA inhibitors 百时美施贵宝公司 2023-11-03 CN 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
CN-110845498-B Macrocyclic compounds having heterocyclic P2' groups as factor XIA inhibitors 百时美施贵宝公司 2023-02-17 CN disclosed
WO-2022272132-A2 COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL INFECTION AZITRA INC (US) 2022-12-29 WO disclosed
EP-3868753-B1 FACTOR XIA MACROCYCLIC INHIBITORS BEARING A NON-AROMATIC P2' GROUP BRISTOL MYERS SQUIBB CO (US) 2022-12-21 EP disclosed
CN-114874222-A Carrying non-aromatic P2 , Novel macrocyclic form of factor XIA 百时美施贵宝公司 2022-08-09 CN disclosed
CN-114805365-A Carrying non-aromatic P2 , Novel macrocyclic form of factor XIA 百时美施贵宝公司 2022-07-29 CN disclosed
EP-3988549-A1 MACROCYCLES WITH HETEROCYCLIC P2' GROUPS AS FACTOR XIA INHIBITORS Bristol-Myers Squibb Company (US) 2022-04-27 EP disclosed
EP-1398326-B1 Monoclonal antibodies against recombinant stratum corneum chymotryptic enzyme (SCCE) THORBJOERN EGELRUD (SE) 2006-01-11 EP disclosed
EP-1398326-A2 Monoclonal antibodies against recombinant stratum corneum chymotryptic enzyme (SCCE) Egelrud, Torbjörn (SE) 2004-03-17 EP disclosed
EP-0703985-B1 RECOMBINANT STRATUM CORNEUM CHYMOTRYPTIC ENZYME (SCCE) EGELRUD TORBJOERN (SE) 2003-10-29 EP disclosed
US-5981256-A NUCLEOTIDE SEQUENCE CODING A PROTEOLYTIC POLYPEPTIDE FOR THE TREATMENT OR PROPHYLAXIS OF DISEASES SUCH AS ACNE, PSORIASIS, ECZEMAS, SKIN DISORDERS, AUTOIMMUNE AND INFLAMMATORY SKIN DISEASES ASTRA AKTIEBOLAG (SE) 1999-11-09 US disclosed
US-5834290-A SKIN DISORDERS SUCH AS ACNE, XERODERMA, HYPERKERATOTIC CONDITIONS, CALLOSITIES AND KERATOSIS PILARIS; ICHTHYOSES, PSORIASIS AND ECZEMAS; AUTOIMMUNE PEMPHIGUS, ACATHOLYTIC DISEASES, FAMILIAR PEMPHIGUS AND DARIER'S DISEASE ASTRA AKTIEBOLAG (SE) 1998-11-10 US disclosed
EP-0703985-A1 RECOMBINANT STRATUM CORNEUM CHYMOTRYPTIC ENZYME (SCCE) Astra Aktiebolag (SE) 1996-04-03 EP disclosed
WO-1995000651-A1 RECOMBINANT STRATUM CORNEUM CHYMOTRYPTIC ENZYME (SCCE) ASTRA AKTIEBOLAG (SE) 1995-01-05 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 NTSR2 3395/4885NTSR1 2950/4885SORT1 1953/4885

“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.