SCHEMBL21790934

SCHEMBL21790934

Cc1ccc(N(c2ccc3c(c2)C(C)(C)c2cc4c(cc2-3)C(C)(C)c2ccc3oc5ccccc5c3c2-4)c2ccc3c(c2)C(C)(C)c2cc(-c4cccc(-c5ccccc5)c4)c4oc5ccccc5c4c2-3)cc1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 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
SCHEMBL21790945 0.96 — —
SCHEMBL21790930 0.95 — —
SCHEMBL21790722 0.95 CDC14B (0.30) —
SCHEMBL21790921 0.93 — —
SCHEMBL21790948 0.92 MAOB (0.30) —
SCHEMBL21790634 0.92 CDC14B (0.31) —
SCHEMBL21790935 0.91 CDC14B (0.31) —
SCHEMBL21790718 0.91 CDC14B (0.31) —
SCHEMBL21790693 0.90 — —
SCHEMBL21790937 0.90 — —

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-2020043646-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-03-05 — — WO disclosed
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