SCHEMBL19044569

SCHEMBL19044569

C=N/C(C)=C\C=C(/C)c1cccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccccc4)cc3)n2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.37
▸ KMT2A Q03164 6/20 0.37
▸ MAPT P10636 6/20 0.37
▸ HPGD P15428 6/20 0.37
▸ ALDH1A1 P00352 5/20 0.37
▸ KDM4E B2RXH2 3/20 0.37
▸ LMNA P02545 3/20 0.37
▸ GLA P06280 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ NTSR1 P30989 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ GAA P10253 2/20 0.33
▸ KMO O15229 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ MAP4K4 O95819 1/20 0.33
▸ CSNK1G2 P78368 1/20 0.33
▸ CLK4 Q9HAZ1 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
SCHEMBL19413708 0.90 SIRT2 (0.38) MAP4K4CSNK1G2CLK4MKNK2MAP4K5
SCHEMBL23921309 0.79 ALDH1A1 (0.40) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL23921308 0.78 CYP17A1 (0.38) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL23712244 0.78 CYP17A1 (0.38) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL20682568 0.76 KMO (0.36) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL23921338 0.75 CYP17A1 (0.40) MEN1KMT2AMAPTPOLB
SCHEMBL24642252 0.75 KMO (0.41) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL19607395 0.74 KMO (0.38) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL19607481 0.73 KMO (0.36) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL25553857 0.70 L3MBTL1 (0.40) MEN1KMT2AMAPTHPGDALDH1A1

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
US-20170186975-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-29 — — US disclosed
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