SCHEMBL5688804

SCHEMBL5688804

CCC1(C(C)OCC2CC3C=CC2C3)COC1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL4937724 0.74 KDM4E (0.42) KDM4EALDH1A1
SCHEMBL5360041 0.73 KDM4E (0.39) KDM4EALDH1A1
SCHEMBL1949404 0.72 KDM4E (0.37) KDM4EALDH1A1
SCHEMBL5356106 0.72 KDM4E (0.41) KDM4EALDH1A1
SCHEMBL416851 0.71 KDM4E (0.44) KDM4EALDH1A1
SCHEMBL1949402 0.70
SCHEMBL5353103 0.70 KDM4E (0.40) KDM4EALDH1A1
SCHEMBL2515488 0.69
SCHEMBL14188611 0.69 KDM4E (0.41) KDM4EALDH1A1
SCHEMBL18719772 0.68 KDM4E (0.39) KDM4EALDH1A1

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-1652886-A1 Photocationic curable composition and new compound DAINIPPON INK AND CHEMICALS, INC. (JP) 2006-05-03 EP disclosed