SCHEMBL6963777

SCHEMBL6963777

N#CCNC(=O)c1c[c]ccc1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSL P07711 10/20 0.43
CTSS P25774 6/20 0.43
CTSK P43235 5/20 0.43
CTSB P07858 5/20 0.43
NAMPT P43490 1/20 0.43
EGLN1 Q9GZT9 1/20 0.40
GAA P10253 1/20 0.39

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
SCHEMBL158021 0.83 GAA (0.41) GAA
SCHEMBL2863808 0.80 GAA (0.61) CTSLCTSSCTSKCTSBNAMPT
SCHEMBL1490709 0.80 L3MBTL1 (0.55) GAA
SCHEMBL3313893 0.79 GAA (0.41) GAA
SCHEMBL2156507 0.79 NAMPT (0.47) CTSLCTSSCTSKCTSBNAMPT
SCHEMBL159472 0.79 KMT2A (0.63) GAA
SCHEMBL1415854 0.78 POLB (0.46) GAA
SCHEMBL1416098 0.78 HPGD (0.59)
SCHEMBL4318844 0.78 SMN1; SMN2 (0.64) GAA
SCHEMBL8961219 0.77 HDAC3 (0.32) GAA

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
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed