SCHEMBL9011304

SCHEMBL9011304

CCOC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)OC(C)(C)C

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
REN P00797 2/20 0.58
PSMB1 P20618 12/20 0.57
PSMB5 P28074 12/20 0.57
PSMB9 P28065 10/20 0.57
PSMB8 P28062 10/20 0.57
PSMB10 P40306 7/20 0.57
PSMB2 P49721 6/20 0.57
BCL2 P10415 1/20 0.51
PTPN1 P18031 1/20 0.49
YAP1 P46937 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
SCHEMBL9011201 0.88 PSMB1 (0.59) RENPSMB1PSMB5PSMB9PSMB8
SCHEMBL9011324 0.87 OPRD1 (0.59) PTPN1
SCHEMBL21430307 0.87 REN (0.65) RENPSMB1PSMB5PSMB9PSMB8
SCHEMBL8571242 0.87 PSMB1 (0.61) RENPSMB1PSMB5PSMB9PSMB8
SCHEMBL8571238 0.87 PSMB1 (0.61) RENPSMB1PSMB5PSMB9PSMB8
SCHEMBL11604023 0.86 CTSS (0.56) RENPSMB1PSMB5PSMB9PSMB8
SCHEMBL12706390 0.85 REN (0.68) RENPSMB1PSMB5PSMB9PSMB8
SCHEMBL30538832 0.85 REN (0.64) RENPSMB1PSMB5PSMB9PSMB8
SCHEMBL9011112 0.84 REN (0.66) REN
SCHEMBL9011111 0.84 REN (0.66) REN

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5525727-A ANALGESIC OR NARCOTIC ANTAGONIST UNIVERSITY OF FLORIDA (US) 1996-06-11 US disclosed
EP-0110955-B1 BRAIN-SPECIFIC DRUG DELIVERY UNIV FLORIDA (US) 1995-08-23 EP disclosed
US-5187158-A Sustained delivery of viricides UNIVERSITY OF FLORIDA (US) 1993-02-16 US disclosed
US-5008257-A Penicillin or cephalosporin antibiotics UNIVERSITY OF FLORIDA (US) 1991-04-16 US disclosed
US-4900837-A Brain-specific drug delivery of steroid sex hormones cleaved from pyridinium carboxylates and dihydro-pyridine carboxylate precursors UNIVERSITY OF FLORIDA (US) 1990-02-13 US disclosed
US-4880921-A Brain-specific drug delivery UNIVERSITY OF FLORIDA (US) 1989-11-14 US disclosed
US-4824850-A DIHYDROPYRIDINE-PYRIDINIUM SALT REDOX CARRIER UNIVERSITY OF FLORIDA (US) 1989-04-25 US disclosed
US-4540564-A DIHYDROPYRIDINE AND/OR PYRIDINIUM SALT REDOX CARRIER UNIVERSITY OF FLORIDA (US) 1985-09-10 US disclosed
EP-0110955-A1 BRAIN-SPECIFIC DRUG DELIVERY. UNIV FLORIDA (US) 1984-06-20 EP disclosed
WO-1983003968-A1 BRAIN-SPECIFIC DRUG DELIVERY UNIVERSITY OF FLORIDA (US) 1983-11-24 WO disclosed