SCHEMBL15046209

SCHEMBL15046209

CC1(C)c2cc(-c3ccc4cc(Nc5ccccc5)ccc4c3)ccc2-c2cc3c(cc21)N(c1ccccc1)c1ccccc1C3(C)C

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ PDK2 Q15119 1/20 0.34
▸ GNG2 P59768 1/20 0.33
▸ GNB1 P62873 1/20 0.33
▸ MARK3 P27448 1/20 0.33
▸ APP P05067 1/20 0.32
▸ SNCA P37840 1/20 0.32
▸ ABL1 P00519 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ GFER P55789 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL15046206 0.94 PGR (0.41) PGRPDK2GNG2GNB1MARK3
SCHEMBL15046214 0.93 PGR (0.41) PGRPDK2GNG2GNB1MARK3
SCHEMBL15046213 0.90 PGR (0.43) PGRALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL15046328 0.88 PGR (0.33) PGRPDK2
SCHEMBL15046204 0.88 PGR (0.46) PGRALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL15046324 0.83 PGR (0.32) PGRALDH1A1MEN1KMT2A
SCHEMBL15046257 0.83 PDK2 (0.32) PGRPDK2
SCHEMBL15046242 0.83 PGR (0.35) PGRALDH1A1PDK2
SCHEMBL15046325 0.83 PGR (0.35) PGRALDH1A1PDK2
SCHEMBL16900626 0.81 PGR (0.42) PGRALDH1A1PDK2MEN1KMT2A

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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