SCHEMBL4615245

SCHEMBL4615245

CCN1CC(=NN)N(CC)C1=O

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.39
ELANE P08246 1/20 0.39
CTSG P08311 1/20 0.39
CTRC Q99895 1/20 0.39
GMNN O75496 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
THPO P40225 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MGLL Q99685 1/20 0.31

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
SCHEMBL5280132 0.75 F2 (0.34) F2ELANECTSGCTRC
SCHEMBL417344 0.73 F2 (0.48) F2ELANECTSGCTRCGMNN
SCHEMBL6362484 0.71 F2 (0.46) F2ELANECTSGCTRCGMNN
SCHEMBL23871024 0.69 F2 (0.44) F2ELANECTSGCTRCGMNN
SCHEMBL24220321 0.68 F2 (0.42) F2ELANECTSGCTRCGMNN
SCHEMBL10963708 0.64 F2 (0.37) F2ELANECTSGCTRC
SCHEMBL7745388 0.64 F2 (0.37) F2ELANECTSGCTRC
SCHEMBL632190 0.64 F2 (0.37) F2ELANECTSGCTRC
SCHEMBL16613893 0.63 F2 (0.35) F2ELANECTSGCTRC
SCHEMBL6360685 0.62 HSD17B3 (0.43) LMNAMGLL

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-1601335-B1 MEANS AND METHOD FOR THE SIMULTANEOUS BLEACHING AND DYEING OF KERATIN FIBRES WELLA AG (DE) 2008-03-19 EP claimed
EP-1601335-B1 MEANS AND METHOD FOR THE SIMULTANEOUS BLEACHING AND DYEING OF KERATIN FIBRES WELLA AG (DE) 2008-03-19 EP disclosed
EP-1699427-B1 AGENT AND METHOD FOR OXIDATIVELY DYING KERATIN FIBERS WELLA AG (DE) 2008-02-27 EP disclosed