SCHEMBL7641395

SCHEMBL7641395

COC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSL P07711 5/20 0.72
CTSB P07858 4/20 0.72
CTSS P25774 4/20 0.72
CTSK P43235 1/20 0.72
TACR1 P25103 2/20 0.62
ALDH1A1 P00352 1/20 0.60
ALOX15 P16050 1/20 0.60

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
SCHEMBL13220863 1.00 CTSL (0.72) CTSLCTSBCTSSCTSKTACR1
SCHEMBL11516887 0.92 CTSS (0.62) CTSLCTSBCTSSCTSKTACR1
SCHEMBL6661701 0.90 CTSL (0.69) CTSLCTSBCTSSCTSKTACR1
SCHEMBL10790294 0.90 CTSL (0.69) CTSLCTSBCTSSCTSKTACR1
SCHEMBL9557048 0.88 CTSL (0.73) CTSLCTSBCTSSCTSKTACR1
SCHEMBL7314524 0.88 CTSL (0.73) CTSLCTSBCTSSCTSKTACR1
SCHEMBL24115146 0.88 CTSK (0.73) CTSLCTSBCTSSCTSK
SCHEMBL20669315 0.88 CTSK (0.73) CTSLCTSBCTSSCTSK
SCHEMBL8335400 0.87 CTSL (0.71) CTSLCTSBCTSSCTSKTACR1
SCHEMBL5177047 0.87 CTSS (0.56) CTSLCTSBCTSSCTSKALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1180115-A1 MINIMAL ISOLATION PEPTIDE SYNTHESIS PROCESS USING ION-EXCHANGE RESINS AS SCAVENGING AGENTS ABBOTT LABORATORIES (US) 2002-02-20 EP disclosed
WO-2000071569-A1 MINIMAL ISOLATION PEPTIDE SYNTHESIS PROCESS USING ION-EXCHANGE RESINS AS SCAVENGING AGENTS ABBOTT LABORATORIES (US) 2000-11-30 WO disclosed
EP-0248562-B1 Difluoro peptide compounds ZENECA INC (US) 1995-10-25 EP disclosed
US-4873221-A Difluoro peptide compounds ICI AMERICAS INC. (US) 1989-10-10 US disclosed
EP-0248562-A2 Difluoro peptide compounds ZENECA INC. (US) 1987-12-09 EP disclosed