SCHEMBL7363047

SCHEMBL7363047

N[C@@H](Cc1ccccc1)C(=O)NC1C(=O)NC1Oc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSL P07711 15/20 0.66
CTSK P43235 15/20 0.66
CTSS P25774 11/20 0.66
CTSB P07858 1/20 0.45
ALPI P09923 1/20 0.42
PKM P14618 1/20 0.42
PTGS1 P23219 1/20 0.42
XIAP P98170 1/20 0.42
SLC7A5 Q01650 1/20 0.42
LTA4H P09960 1/20 0.42

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
SCHEMBL7361168 1.00 CTSL (0.66) CTSLCTSKCTSSCTSBALPI
SCHEMBL7438845 0.92 CTSL (0.57) CTSLCTSKCTSSCTSB
SCHEMBL7436896 0.86 CTSK (0.67) CTSLCTSKCTSSCTSBLTA4H
SCHEMBL7030571 0.81 CTSK (0.50) CTSLCTSKCTSSCTSB
SCHEMBL8158075 0.80 CTSL (0.61) CTSLCTSKCTSSCTSB
SCHEMBL7506810 0.80 CTSL (0.61) CTSLCTSKCTSSCTSB
SCHEMBL7447217 0.79 CTSL (0.72) CTSLCTSKCTSSCTSB
SCHEMBL7494546 0.79 CTSK (0.72) CTSLCTSKCTSSCTSB
SCHEMBL7474895 0.75 CTSK (0.89) CTSLCTSKCTSSCTSB
SCHEMBL7471864 0.75 CTSK (0.89) CTSLCTSKCTSSCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999048911-A1 MONOBACTAM ENZYME INHIBITORS NAEJA PHARMACEUTICAL INC. (GB) 1999-09-30 WO disclosed