SCHEMBL18915034

SCHEMBL18915034

C/C=C\c1c(C)cc(-c2ccccc2)c2cccc(-c3c([N+](=O)[O-])ccc(Nc4ccccc4)c3C=N)c12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 5/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ TDP1 Q9NUW8 4/20 0.37
▸ MAPT P10636 2/20 0.37
▸ POLB P06746 2/20 0.37
▸ AKR1C4 P17516 3/20 0.36
▸ AKR1C3 P42330 3/20 0.36
▸ AKR1C2 P52895 3/20 0.36
▸ AKR1C1 Q04828 3/20 0.36
▸ AR P10275 1/20 0.36
▸ WNK1 Q9H4A3 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ MYC P01106 3/20 0.34
▸ HCAR3 P49019 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CASP7 P55210 1/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ MEN1 O00255 2/20 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
SCHEMBL18915044 0.76 HPRT1 (0.42) L3MBTL1SMN1; SMN2TDP1MAPTPOLB
SCHEMBL18915036 0.75 L3MBTL1 (0.42) L3MBTL1SMN1; SMN2TDP1MAPTPOLB
SCHEMBL18914938 0.72 TDP1 (0.45) L3MBTL1SMN1; SMN2TDP1MAPTPOLB
SCHEMBL27955275 0.64 TDP1 (0.59) SMN1; SMN2TDP1MAPTALDH1A1KMT2A
SCHEMBL17154869 0.62 L3MBTL1 (0.55) L3MBTL1SMN1; SMN2TDP1MAPTPOLB
SCHEMBL22779181 0.62 TDP1 (0.51) L3MBTL1SMN1; SMN2TDP1MAPTPOLB
SCHEMBL9325996 0.60 AKR1C4 (0.70) L3MBTL1SMN1; SMN2TDP1MAPTPOLB
SCHEMBL18915033 0.60 TDP1 (0.41) L3MBTL1SMN1; SMN2TDP1MAPTPOLB
SCHEMBL18104290 0.60 L3MBTL1 (0.55) L3MBTL1SMN1; SMN2TDP1MAPTPOLB
SCHEMBL22779179 0.60 TDP1 (0.51) L3MBTL1SMN1; SMN2TDP1MAPTPOLB

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-2017090901-A1 ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 주식회사 두산 2017-06-01 — — WO disclosed
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