SCHEMBL7313231

SCHEMBL7313231

NC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1ccccc1Cc1ccc2ccccc2c1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 20/20 0.67
CTSB P07858 3/20 0.64
CTSL P07711 1/20 0.64
CTSS P25774 2/20 0.48
CTSK P43235 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
SCHEMBL6940473 1.00 CAPN1 (0.67) CAPN1CTSBCTSLCTSSCTSK
SCHEMBL7322071 0.83 CAPN1 (0.67) CAPN1CTSBCTSL
SCHEMBL7782111 0.81 CAPN1 (0.71) CAPN1
SCHEMBL7782112 0.81 CAPN1 (0.71) CAPN1
SCHEMBL7782199 0.80 CAPN1 (1.00) CAPN1CTSBCTSL
SCHEMBL7782194 0.80 CAPN1 (1.00) CAPN1CTSBCTSL
SCHEMBL7313223 0.80 CAPN1 (0.57) CAPN1CTSBCTSLCTSSCTSK
SCHEMBL7318624 0.78 CAPN1 (1.00) CAPN1CTSBCTSLCTSSCTSK
SCHEMBL7318629 0.78 CAPN1 (1.00) CAPN1CTSBCTSLCTSSCTSK
SCHEMBL7318636 0.78 CAPN1 (1.00) CAPN1CTSBCTSLCTSSCTSK

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
US-6103720-A ENZYME INHIBITORS; ANTIICHEMIC AND -TUMOR AGENTS; STROKES; ALZEIMER'S DISEASE BASF AKTIENGESELLSCHAFT (DE) 2000-08-15 US disclosed