SCHEMBL10900677

SCHEMBL10900677

CCC(=O)C(CC)n1cncn1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
PDE4D Q08499 1/20 0.38
FAAH O00519 1/20 0.36
MGLL Q99685 1/20 0.36
KMT2A Q03164 2/20 0.35
HSP90AA1 P07900 2/20 0.35
CYP19A1 P11511 4/20 0.35
CYP3A4 P08684 1/20 0.34
EGLN3 Q9H6Z9 1/20 0.33
LMNA P02545 1/20 0.33
PPARG P37231 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MEN1 O00255 1/20 0.32

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
SCHEMBL5440264 0.84 MAPT (0.49) MAPTPDE4DKMT2AHSP90AA1CYP19A1
SCHEMBL2754295 0.82 MAPT (0.44) MAPTPDE4DFAAHMGLLKMT2A
SCHEMBL7104933 0.80 MAPT (0.39) MAPTPDE4DFAAHMGLLKMT2A
SCHEMBL9748570 0.79 MAPT (0.63) MAPTPDE4DKMT2AHSP90AA1CYP19A1
SCHEMBL10717091 0.78 MAPT (0.37) MAPTPDE4DFAAHMGLLLMNA
SCHEMBL10798232 0.71 MAPT (0.45) MAPTPDE4DKMT2AHSP90AA1CYP19A1
SCHEMBL5306513 0.71 FAAH (0.49) MAPTFAAHMGLLKMT2AHSP90AA1
SCHEMBL29776985 0.71
SCHEMBL10361017 0.70 ALDH1A1 (0.46) MAPTPDE4DFAAHMGLLKMT2A
SCHEMBL6107652 0.70 MAPT (0.40) MAPTKMT2AHSP90AA1CYP19A1CYP3A4

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-0198165-A1 Wood preservative DESOWAG Materialschutz GmbH (DE) 1986-10-22 EP disclosed