SCHEMBL15046306

SCHEMBL15046306

CC1(C)c2ccccc2N(c2ccccc2)c2ccc(/C=C/c3ccc(-c4ccc(Nc5ccc6ccccc6c5)cc4)cc3)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ PGR P06401 1/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ RELA Q04206 1/20 0.36
▸ MAPT P10636 5/20 0.34
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ LMNA P02545 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ ALOX12 P18054 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ GNG2 P59768 1/20 0.33
▸ GNB1 P62873 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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 0.90 PGR (0.39) ALDH1A1CYP3A4HPGDHSD17B10PGR
SCHEMBL15046340 0.90 PGR (0.39) ALDH1A1CYP3A4HPGDHSD17B10PGR
SCHEMBL15046278 0.89 PGR (0.39) ALDH1A1CYP3A4HPGDHSD17B10PGR
SCHEMBL15046285 0.87 PGR (0.40) ALDH1A1PGRMAPTMEN1KMT2A
SCHEMBL15046332 0.87 PGR (0.41) ALDH1A1CYP3A4HPGDHSD17B10PGR
SCHEMBL15046300 0.85 ALDH1A1 (0.40) ALDH1A1CYP3A4HPGDHSD17B10PGR
SCHEMBL15046213 0.85 PGR (0.43) ALDH1A1CYP3A4HPGDHSD17B10PGR
SCHEMBL15046426 0.85 KDM4E (0.34) ALDH1A1PGRKDM4ERELAMAPT
SCHEMBL15046443 0.85 PGR (0.37) ALDH1A1PGRMAPTMEN1KMT2A
SCHEMBL15046377 0.85 MEN1 (0.34) ALDH1A1CYP3A4HPGDHSD17B10PGR

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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