SCHEMBL15811172

SCHEMBL15811172

c1ccc(N(c2ccccc2)c2ccc(-n3c4ccccc4c4ccc5c(cnn5-c5ccccc5)c43)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.41
▸ ATM Q13315 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ CYP1A2 P05177 2/20 0.38
▸ CYP17A1 P05093 1/20 0.38
▸ TP53 P04637 2/20 0.34
▸ GRM1 Q13255 3/20 0.34
▸ GRM5 P41594 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ NR3C1 P04150 3/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ CCR1 P32246 1/20 0.32
▸ LMNA P02545 2/20 0.32
▸ TSHR P16473 2/20 0.32
▸ HTT P42858 2/20 0.32
▸ POLB P06746 1/20 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
SCHEMBL19051870 0.89 RAC2 (0.39) KDM4EATML3MBTL1SMN1; SMN2HPGD
SCHEMBL19052210 0.89 NR3C1 (0.39) KDM4EATML3MBTL1SMN1; SMN2HPGD
SCHEMBL19051912 0.87 KDM4E (0.35) KDM4EATML3MBTL1SMN1; SMN2HPGD
SCHEMBL15073662 0.87 KDM4E (0.55) KDM4EATML3MBTL1HPGDCYP1A2
SCHEMBL19031819 0.85 GRM1 (0.47) KDM4EATML3MBTL1SMN1; SMN2HPGD
SCHEMBL15811437 0.84 NR3C1 (0.43) KDM4ESMN1; SMN2HPGDNPC1RAB9A
SCHEMBL19342643 0.84 KDM4E (0.55) KDM4EATML3MBTL1HPGDCYP1A2
SCHEMBL10205988 0.84 KDM4E (0.55) KDM4EATML3MBTL1HPGDCYP1A2
SCHEMBL15811238 0.84 KDM4E (0.42) KDM4EATML3MBTL1SMN1; SMN2NPC1
SCHEMBL18915069 0.83 RAB9A (0.37) KDM4EATML3MBTL1SMN1; SMN2HPGD

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-2014092351-A1 NOVEL ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 (KR) 2014-06-19 — — WO disclosed
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