SCHEMBL18528611

SCHEMBL18528611

CCO[Ti](CO)(OCC)OCC

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
TSHR P16473 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
SCHEMBL436115 0.72
SCHEMBL18528757 0.71 ALDH1A1 (0.30) ALDH1A1
SCHEMBL1794694 0.67
SCHEMBL15453537 0.67
SCHEMBL810631 0.65
SCHEMBL2790722 0.65
SCHEMBL2452950 0.65 ALDH1A1 (0.30) ALDH1A1
Ether SCHEMBL9058622 0.62 ALDH1A1 (0.56) ALDH1A1TSHR
Ether SCHEMBL2801167 0.62 ALDH1A1 (0.56) ALDH1A1TSHR
Ether SCHEMBL6581224 0.62 ALDH1A1 (0.56) ALDH1A1TSHR

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-20170054098-A1 ORGANIC ELECTROLUMINESCENT ELEMENT Konica Minolta, Inc. (JP) 2017-02-23 US disclosed