SCHEMBL18540692

SCHEMBL18540692

NC(=S)N/N=C(\c1cccc(O)c1)c1cccc(Br)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CTSL P07711 18/20 1.00
CTSB P07858 2/20 0.74

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
SCHEMBL18529840 1.00 CTSL (1.00) CTSLCTSB
SCHEMBL6337731 1.00 CTSL (1.00) CTSLCTSB
SCHEMBL29543636 1.00 CTSL (1.00) CTSLCTSB
SCHEMBL31174804 1.00 CTSL (1.00) CTSLCTSB
SCHEMBL18540696 0.93 CTSL (0.92) CTSLCTSB
SCHEMBL18540713 0.93 CTSL (1.00) CTSLCTSB
SCHEMBL2675409 0.93 CTSL (0.86) CTSLCTSB
SCHEMBL2675161 0.88 CTSL (0.80) CTSLCTSB
SCHEMBL6337559 0.88 CTSL (0.80) CTSLCTSB
SCHEMBL6337649 0.88 CTSL (0.84) CTSLCTSB

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-2017030983-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF CATHEPSINS MATEON THERAPEUTICS, INC. (US) 2017-02-23 WO disclosed