SCHEMBL2583829

SCHEMBL2583829

CC(C)(C)OC(=O)[C@@H](COCc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.55
CTSS P25774 1/20 0.53
KLK7 P49862 2/20 0.52
KLK5 Q9Y337 2/20 0.52
PPARG P37231 1/20 0.51
TNF P01375 1/20 0.50
MDM4 O15151 2/20 0.49
TP53 P04637 2/20 0.49
MDM2 Q00987 1/20 0.46
CASP3 P42574 1/20 0.46
SYK P43405 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
SCHEMBL30844631 1.00 PPARA (0.55) PPARACTSSKLK7KLK5PPARG
SCHEMBL28430224 1.00 PPARA (0.55) PPARACTSSKLK7KLK5PPARG
SCHEMBL30416417 1.00 PPARA (0.55) PPARACTSSKLK7KLK5PPARG
SCHEMBL28430225 1.00 PPARA (0.55) PPARACTSSKLK7KLK5PPARG
SCHEMBL15381001 0.90 PPARA (0.48) PPARACTSSPPARGTNFMDM4
SCHEMBL8749905 0.90 MDM4 (0.51) MDM4TP53MDM2CASP3
SCHEMBL13878600 0.88 CTSS (0.59) PPARACTSSKLK7KLK5PPARG
SCHEMBL30844644 0.88 HDAC1 (0.52) CTSSTNFMDM4TP53CASP3
SCHEMBL25444784 0.88 SYK (0.53) CTSSTNFMDM4TP53MDM2
SCHEMBL29902226 0.88 SYK (0.53) CTSSTNFMDM4TP53MDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240115553-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN INJURY AZEVAN PHARMACEUTICALS, INC. (US) 2024-04-11 US disclosed
US-20230123729-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASES AZEVAN PHARMACEUTICALS INC (US) 2023-04-20 US disclosed
US-11628160-B2 Compositions and methods for treating brain injury AZEVAN PHARMACEUTICALS, INC. (US) 2023-04-18 US disclosed
EP-3122743-B1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASES AZEVAN PHARMACEUTICALS INC (US) 2022-11-09 EP disclosed
US-11319306-B2 Compositions and methods for treating neurodegenerative diseases AZEVAN PHARMACEUTICALS, INC. (US) 2022-05-03 US disclosed
US-10953001-B2 Methods for treating post traumatic stress disorder AZEVAN PHARMACEUTICALS, INC. (US) 2021-03-23 US disclosed
EP-3351104-B1 COMPOUNDS FOR USE IN THE TREATMENT OF INTERMITTENT EXPLOSIVE DISORDER AZEVAN PHARMACEUTICALS INC (US) 2020-12-09 EP disclosed
US-20200276167-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN INJURY AZEVAN PHARMACEUTICALS INC (US) 2020-09-03 US disclosed
US-20200102294-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2020-04-02 US disclosed
US-10364236-B2 Compositions and methods for treating neurodegenerative diseases AZEVAN PHARMACEUTICALS, INC. (US) 2019-07-30 US disclosed
US-20120220765-A1 BETA-LACTAMYL PHENYLALANINE, CYSTEINE, AND SERINE VASOPRESSIN ANTAGONISTS KOPPEL GARY A (US) 2012-08-30 US disclosed
US-8048874-B2 Beta-lactamyl phenylalanine, cysteine, and serine vasopressin antagonists AZEVAN PHARMACEUTICALS, INC. (US) 2011-11-01 US disclosed
US-20100016274-A1 BETA-LACTAM CANNABINOID RECEPTOR MODULATORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-01-21 US disclosed
US-20090170825-A1 BETA-LACTAMYLALKANOIC ACIDS FOR TREATING PREMENSTRUAL DISORDERS AZEVAN PHARMACEUTICALS, INC. 2009-07-02 US disclosed
US-20080280870-A1 Beta-Lactamyl Phenylalanine, Cysteine, and Serine Vasopressin Antagonists AZEVAN PHARMACEUTICALS, INC. 2008-11-13 US disclosed
WO-2008034032-A2 BETA-LACTAM CANNABINOID RECEPTOR MODULATORS AZEVAN PHARMACEUTICALS, INC. (US) 2008-03-20 WO disclosed
US-7268125-B2 β-lactamyl vasopressin V1a antagonists AZEVAN PHARMACEUTICALS, INC. (US) 2007-09-11 US disclosed
US-7119083-B2 β-Lactamyl vasopressin V1a Antagonists AZEVAN PHARMACEUTICALS, INC. (US) 2006-10-10 US disclosed
EP-1434763-A2 BETA-LACTAMYL VASOPRESSIN V1A ANTAGONISTS Serenix Pharmaceuticals, LLC (US) 2004-07-07 EP disclosed
WO-2003031407-A2 β-LACTAMYL VASOPRESSIN VlaANTAGONISTS SERENIX PHARMACEUTICALS, LLC (US) 2003-04-17 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 (12 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-20240115553-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN INJURY FABP7, PYGB, CHAT PPARA 2116/4885CTSS 150/4885KLK7 798/4885
US-20200102294-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASES HTT, AVPR2, AVPR1B PPARA 478/4885CTSS 505/4885KLK7 2207/4885
US-20080280870-A1 Beta-Lactamyl Phenylalanine, Cysteine, and Serine Vasopressin Antagonists AVPR2, AVPR1A, AVPR1B PPARA 2356/4885CTSS 1214/4885KLK7 1308/4885
US-20120220765-A1 BETA-LACTAMYL PHENYLALANINE, CYSTEINE, AND SERINE VASOPRESSIN ANTAGONISTS AVPR2, AVPR1A, AVPR1B PPARA 2356/4885CTSS 1214/4885KLK7 1308/4885
US-10953001-B2 Methods for treating post traumatic stress disorder GPX4, CRH, TXN PPARA 2002/4885CTSS 568/4885KLK7 818/4885
US-20100016274-A1 BETA-LACTAM CANNABINOID RECEPTOR MODULATORS CNR2, CNR1, FAAH2 PPARA 147/4885CTSS 2582/4885KLK7 4668/4885
US-20200276167-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN INJURY FABP7, PYGB, CHAT PPARA 2116/4885CTSS 150/4885KLK7 798/4885
US-20090170825-A1 BETA-LACTAMYLALKANOIC ACIDS FOR TREATING PREMENSTRUAL DISORDERS GABBR1, GABBR2, ALAD PPARA 88/4885CTSS 2586/4885KLK7 2818/4885
US-11319306-B2 Compositions and methods for treating neurodegenerative diseases HTT, AVPR2, AVPR1B PPARA 478/4885CTSS 505/4885KLK7 2207/4885
US-20230123729-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASES HTT, AVPR2, AVPR1B PPARA 478/4885CTSS 505/4885KLK7 2207/4885
US-10364236-B2 Compositions and methods for treating neurodegenerative diseases HTT, AVPR2, AVPR1B PPARA 478/4885CTSS 505/4885KLK7 2207/4885
US-11628160-B2 Compositions and methods for treating brain injury FABP7, PYGB, CHAT PPARA 2116/4885CTSS 150/4885KLK7 798/4885

“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.