SCHEMBL15046112

SCHEMBL15046112

CC(C)(C)c1ccc(N2c3ccccc3C(C)(C)c3cc4c(cc32)C(C)(C)c2cc(C=O)ccc2-4)cc1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 1/20 0.38
▸ NR1H3 Q13133 1/20 0.38
▸ LMNA P02545 1/20 0.30
▸ HTT P42858 1/20 0.30

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
SCHEMBL15046390 0.91 NR1H2 (0.33) NR1H2NR1H3
SCHEMBL15118493 0.90 NR1H2 (0.38) NR1H2NR1H3LMNAHTT
SCHEMBL15046420 0.90 NR1H2 (0.40) NR1H2NR1H3HTT
SCHEMBL15046271 0.89 PGR (0.36) LMNAHTT
SCHEMBL15046355 0.89 NR1H2 (0.39) NR1H2NR1H3HTT
SCHEMBL15046250 0.84 NR1H2 (0.39) NR1H2NR1H3
SCHEMBL15046239 0.84 NR1H2 (0.39) NR1H2NR1H3
SCHEMBL15046280 0.84 ALDH1A1 (0.35) LMNAHTT
SCHEMBL15019957 0.84 PDK2 (0.34) NR1H2NR1H3
SCHEMBL15119780 0.82 PGR (0.42) —

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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