SCHEMBL15638452

SCHEMBL15638452

c1ccc2c(c1)[nH]c1ccc(-c3cccc4[nH]c5ccc6c7ccccc7sc6c5c34)cc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.49
▸ KMT2A Q03164 4/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ MAPT P10636 2/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ TNKS O95271 2/20 0.43
▸ TNKS2 Q9H2K2 2/20 0.43
▸ GABRP O00591 1/20 0.41
▸ GABRD O14764 1/20 0.41
▸ GABRA1 P14867 1/20 0.41
▸ GABRB1 P18505 1/20 0.41
▸ GABRG2 P18507 1/20 0.41
▸ GABRB3 P28472 1/20 0.41
▸ GABRA5 P31644 1/20 0.41
▸ GABRA3 P34903 1/20 0.41
▸ GABRA2 P47869 1/20 0.41
▸ GABRB2 P47870 1/20 0.41
▸ GABRA4 P48169 1/20 0.41
▸ GABRE P78334 1/20 0.41
▸ GABRA6 Q16445 1/20 0.41

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
SCHEMBL17117653 0.90 ALOX5 (0.56) ALOX5KMT2AMEN1MAPTRAB9A
SCHEMBL31664386 0.89 ALOX5 (0.61) ALOX5KMT2AMEN1MAPTRAB9A
SCHEMBL457901 0.89 ALOX5 (0.61) ALOX5KMT2AMEN1MAPTRAB9A
SCHEMBL29720834 0.89 ALOX5 (0.61) ALOX5KMT2AMEN1MAPTRAB9A
SCHEMBL26022356 0.86 ALOX5 (0.58) ALOX5KMT2AMEN1MAPTRAB9A
SCHEMBL787967 0.86 ALOX5 (0.64) ALOX5KMT2AMEN1MAPTRAB9A
SCHEMBL788292 0.85 ALOX5 (0.59) ALOX5KMT2AMEN1MAPTRAB9A
SCHEMBL30959738 0.85 ALOX5 (0.59) ALOX5KMT2AMEN1MAPTRAB9A
SCHEMBL17117702 0.84 ALOX5 (0.56) ALOX5KMT2AMEN1MAPTRAB9A
SCHEMBL19041622 0.84 ALOX5 (0.55) ALOX5KMT2AMEN1MAPTRAB9A

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-2014054898-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE CONTAINING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2014-04-10 — — WO disclosed
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