SCHEMBL2564595

SCHEMBL2564595

N#Cc1nccc(N(C2CCCCC2)C2CCCCC2)n1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 13/20 0.52
JAK3 P52333 2/20 0.37
GPR4 P46093 1/20 0.36
CTSL P07711 4/20 0.35
CTSS P25774 5/20 0.35
CTSB P07858 2/20 0.35
KMO O15229 1/20 0.34
LCK P06239 1/20 0.34

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
SCHEMBL29324978 0.85 JAK3 (0.53) CTSKJAK3GPR4LCK
SCHEMBL6241634 0.73 CTSK (0.40) CTSKCTSLCTSS
SCHEMBL5794080 0.71 CTSK (0.51) CTSKGPR4CTSLCTSSCTSB
SCHEMBL2228524 0.71 CTSK (0.50) CTSKGPR4KMO
SCHEMBL27227021 0.71 JAK3 (0.40) CTSKJAK3LCK
SCHEMBL154166 0.70 CTSL (0.38) CTSKCTSLCTSS
SCHEMBL31627588 0.69 CTSK (0.38) CTSKJAK3CTSLCTSSCTSB
SCHEMBL31061062 0.69 CTSK (1.00) CTSKCTSLCTSSCTSB
SCHEMBL2566470 0.67 CTSK (0.47) CTSKGPR4CTSSKMO
SCHEMBL1509580 0.66 CTSK (0.49) CTSKCTSSKMO

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
EP-2382240-A2 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP Bridgestone Corporation (JP) 2011-11-02 EP disclosed
WO-2010085622-A9 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2010-12-23 WO disclosed
WO-2010085622-A2 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2010-07-29 WO disclosed