SCHEMBL27633730

SCHEMBL27633730

COc1[c]c(OC)c2oncc2c1.[Ti]

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL27614831 0.67
SCHEMBL27633733 0.63 ALDH1A1 (0.42) KDM4EALDH1A1HPGD
SCHEMBL2303084 0.61 ALDH1A1 (0.41) KDM4EALDH1A1HPGD
SCHEMBL27614880 0.60
SCHEMBL5573064 0.60 KDM4E (0.61) KDM4EALDH1A1HPGD
SCHEMBL744322 0.58 ACHE (0.44) KDM4EALDH1A1HPGD
SCHEMBL7679493 0.58 ACHE (0.34) ALDH1A1
SCHEMBL2306800 0.58 TUBB1 (0.31)
SCHEMBL2302753 0.57 ACHE (0.38)
SCHEMBL305409 0.57

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1727353-A Titanium metallocene photoinitiator with parallel structure, synthetic catalyst and photosensitive composition HUATAI CHEMICAL CO LTD CHANGZH (CN) 2006-02-01 CN claimed
CN-1727353-A Titanium metallocene photoinitiator with parallel structure, synthetic catalyst and photosensitive composition HUATAI CHEMICAL CO LTD CHANGZH (CN) 2006-02-01 CN disclosed