SCHEMBL15046212

SCHEMBL15046212

CC(C)(c1ccccc1)c1cc(-c2ccc3cc(-c4ccc5c(c4)C(C)(C)c4ccccc4N5c4ccc5ccccc5c4)ccc3c2)ccc1Nc1ccc2ccccc2c1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ HSD17B10 Q99714 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
SCHEMBL15046210 0.91 — —
SCHEMBL15046291 0.89 — —
SCHEMBL15046211 0.88 PGR (0.32) —
SCHEMBL15046240 0.82 — —
SCHEMBL15046402 0.81 — —
SCHEMBL15046207 0.81 PGR (0.32) —
SCHEMBL13008725 0.80 — —
SCHEMBL15046215 0.79 KMT2A (0.37) ALDH1A1HPGD
SCHEMBL13557589 0.78 HSP90AA1 (0.41) ALDH1A1CYP3A4HPGD
SCHEMBL17206569 0.77 HSP90AA1 (0.38) ALDH1A1HPGD

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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