SCHEMBL7937324

SCHEMBL7937324

CC(=O)CC#N.CC(=O)CC#N.CC(C)[Ti]C(C)C

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 4/20 0.38
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 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
Ethylamine SCHEMBL28381860 0.92 MCL1 (0.37) MCL1
SCHEMBL86002 0.83
SCHEMBL9012349 0.80
Bromide SCHEMBL28492295 0.80
SCHEMBL27503481 0.80
SCHEMBL29745047 0.80
SCHEMBL7627393 0.80
SCHEMBL1864260 0.80
SCHEMBL7627396 0.80
Ethylene SCHEMBL27584872 0.78

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
US-6232376-B1 BLEND CONTAINING ORGANOSILICON COMPOUND, PEROXIDE, HINDERED AMINE STABILIZER AND ANTIOXIDANTS NIPPON UNICAR COMPANY LTD. (JP) 2001-05-15 US disclosed