SCHEMBL7971603

SCHEMBL7971603

CCCc1c(COc2ccc(C=O)cc2)ccc(C(C)=O)c1OC

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSD P07339 5/20 0.65
CYSLTR2 Q9NS75 15/20 0.64
CYSLTR1 Q9Y271 15/20 0.64

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
SCHEMBL7968343 0.86 CYSLTR2 (0.67) CTSDCYSLTR2CYSLTR1
SCHEMBL7968159 0.80 CTSD (0.65) CTSDCYSLTR2CYSLTR1
SCHEMBL7971385 0.79 CTSD (1.00) CTSDCYSLTR2CYSLTR1
SCHEMBL7971381 0.79 CTSD (1.00) CTSDCYSLTR2CYSLTR1
SCHEMBL8683593 0.74 CTSD (0.57) CTSDCYSLTR2CYSLTR1
SCHEMBL9172468 0.71 LMNA (0.68) CTSDCYSLTR2CYSLTR1
SCHEMBL9173547 0.71 GRM2 (0.68) CTSDCYSLTR2CYSLTR1
SCHEMBL15032723 0.70 MEN1 (0.45) CTSDCYSLTR2CYSLTR1
SCHEMBL9173157 0.70 CYSLTR2 (0.64) CTSDCYSLTR2CYSLTR1
SCHEMBL7046976 0.70 CYSLTR2 (0.45) CTSDCYSLTR2CYSLTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6251928-B1 ADMINISTERING BENZYLIDENE RHODANINES WHICH ARE USEFUL AS AGENTS IN TREATING OR PREVENTING CONDITIONS ASSOCIATED WITH BETA-AMYLOID PEPTIDE IN A MAMMAL ELI LILLY AND COMPANY 2001-06-26 US disclosed
US-5747517-A ALZHEIMER'S DISEASE; PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 1998-05-05 US disclosed
EP-0677517-A1 Treatment of Alzheimer's disease employing inhibitors of cathepsin D ELI LILLY AND COMPANY (US) 1995-10-18 EP disclosed