SCHEMBL15046414

SCHEMBL15046414

CC1(C)c2cc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc5c(cc3-4)C(C)(C)c3ccccc3N5c3ccccc3)cc21

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.33
▸ APP P05067 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ SNCA P37840 2/20 0.32

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
SCHEMBL15046234 0.97 PDK2 (0.31) PDK2APPMAPTSNCA
SCHEMBL15046311 0.93 PDK2 (0.32) PDK2APPMAPTSNCA
SCHEMBL15046363 0.92 PDK2 (0.33) PDK2APPMAPTSNCA
SCHEMBL15046276 0.92 — —
SCHEMBL15046263 0.92 PDK2 (0.36) PDK2APPMAPT
SCHEMBL15046319 0.92 PDK2 (0.35) PDK2
SCHEMBL15046357 0.91 PDK2 (0.36) PDK2
SCHEMBL15046251 0.91 — —
SCHEMBL15046343 0.90 PGR (0.32) PDK2
SCHEMBL15046230 0.88 PDK2 (0.34) PDK2APPMAPTSNCA

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-2013089460-A1 NOVEL CHEMICAL COMPOUND HAVING AN ACRIDINE STRUCTURE, AND ORGANIC LIGHT-EMITTING DIODE USING SAME 주식회사 두산 (KR) 2013-06-20 — — WO disclosed
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