SCHEMBL15084856

SCHEMBL15084856

CC1(C)c2ccccc2N(c2nc(-c3ccccc3)cc(-c3ccccc3)n2)c2ccc(-c3ccc4c(c3)N(c3ccccc3)c3ccccc3N4c3ccccc3)cc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 5/20 0.35
▸ ALDH1A1 P00352 5/20 0.35
▸ KDM4E B2RXH2 4/20 0.35
▸ SMN1; SMN2 Q16637 4/20 0.35
▸ MAPK1 P28482 3/20 0.35
▸ TSHR P16473 2/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ CASP7 P55210 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ MAPT P10636 5/20 0.34
▸ L3MBTL1 Q9Y468 4/20 0.34
▸ NPSR1 Q6W5P4 2/20 0.34
▸ HTT P42858 1/20 0.33
▸ MEN1 O00255 5/20 0.33
▸ KMT2A Q03164 5/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ ADAMTS5 Q9UNA0 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ CYP1A2 P05177 2/20 0.32
▸ CYP2C19 P33261 2/20 0.32

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
SCHEMBL15084870 0.96 HPGD (0.37) HPGDALDH1A1KDM4ESMN1; SMN2MAPK1
SCHEMBL12436273 0.89 HPGD (0.37) HPGDALDH1A1KDM4ESMN1; SMN2MAPK1
SCHEMBL15084758 0.88 ADORA1 (0.33) HPGDALDH1A1KDM4ESMN1; SMN2MAPK1
SCHEMBL15084759 0.87 MEN1 (0.36) HPGDALDH1A1KDM4ESMN1; SMN2MAPK1
SCHEMBL15084799 0.87 ADAMTS5 (0.35) HPGDALDH1A1KDM4ESMN1; SMN2MAPK1
SCHEMBL13832946 0.86 MEN1 (0.40) HPGDALDH1A1KDM4ESMN1; SMN2MAPK1
SCHEMBL15394889 0.85 MEN1 (0.41) HPGDALDH1A1KDM4ESMN1; SMN2MAPK1
SCHEMBL13832934 0.85 MEN1 (0.42) HPGDALDH1A1KDM4EMAPTL3MBTL1
SCHEMBL13833117 0.84 MEN1 (0.35) HPGDALDH1A1KDM4ESMN1; SMN2MAPK1
SCHEMBL15084800 0.84 KMT2A (0.38) HPGDALDH1A1KDM4EMAPTL3MBTL1

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-2013100603-A1 ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC LIGHT EMITTING DIODE USING SAME 주식회사 두산 (KR) 2013-07-04 — — WO disclosed
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