SCHEMBL21603019

SCHEMBL21603019

CC(C)(CN)CN.CCC(N)CCN

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.48

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
SCHEMBL16255540 0.84
SCHEMBL2174997 0.84 GABRR1 (0.32)
SCHEMBL14392147 0.84
SCHEMBL58102 0.84
Hydrochloric Acid SCHEMBL27370476 0.82
Ammonia Solution, Strong SCHEMBL1965549 0.82
Ammonia Solution, Strong SCHEMBL6570546 0.82
Hydrochloric Acid SCHEMBL28285868 0.82
SCHEMBL27792260 0.81
Ammonia Solution, Strong SCHEMBL28313138 0.79

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
WO-2020004503-A1 POSITIVE LITHOGRAPHIC PRINTING PLATE PRECURSOR, METHOD FOR MANUFACTURING LITHOGRAPHIC PRINTING PLATE, AND POSITIVE PHOTOSENSITIVE RESIN COMPOSITION 富士フイルム株式会社 2020-01-02 WO disclosed