SCHEMBL15046300

SCHEMBL15046300

CC1(C)c2ccccc2N(c2ccc3ccccc3c2)c2ccc(/C=C/c3ccc4c(ccc5cc(Nc6ccccc6)ccc54)c3)cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ MAPT P10636 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ ALOX12 P18054 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ PGR P06401 1/20 0.35
▸ RELA Q04206 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ NQO2 P16083 2/20 0.31
▸ GLA P06280 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ HTT P42858 1/20 0.31

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
SCHEMBL15046441 0.93 PGR (0.39) ALDH1A1CYP3A4HPGDHSD17B10MAPT
SCHEMBL15046332 0.92 PGR (0.41) ALDH1A1CYP3A4HPGDHSD17B10MAPT
SCHEMBL15046330 0.89 ALDH1A1 (0.34) ALDH1A1CYP3A4HPGDHSD17B10MAPT
SCHEMBL15046278 0.86 PGR (0.39) ALDH1A1CYP3A4HPGDHSD17B10MAPT
SCHEMBL15046306 0.85 ALDH1A1 (0.39) ALDH1A1CYP3A4HPGDHSD17B10MAPT
SCHEMBL15046394 0.85 RELA (0.41) ALDH1A1HPGDMAPTMEN1KMT2A
SCHEMBL15046262 0.84 PGR (0.38) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL15046391 0.84 RELA (0.41) ALDH1A1HPGDMAPTMEN1KMT2A
SCHEMBL15046340 0.83 PGR (0.39) ALDH1A1CYP3A4HPGDHSD17B10MAPT
SCHEMBL15046351 0.79 CHEK1 (0.31) PGRRELA

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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