SCHEMBL15638451

SCHEMBL15638451

c1ccc2c(c1)[nH]c1ccc(-c3cc4c5ccccc5sc4c4c3[nH]c3ccccc34)cc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.49
▸ MEN1 O00255 4/20 0.49
▸ MAPT P10636 4/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ TNKS O95271 2/20 0.45
▸ TNKS2 Q9H2K2 2/20 0.45
▸ MAP3K9 P80192 3/20 0.44
▸ MAP3K11 Q16584 3/20 0.44
▸ CDK4 P11802 1/20 0.44
▸ CCND1 P24385 1/20 0.44
▸ GABRA1 P14867 2/20 0.43
▸ GABRG2 P18507 2/20 0.43
▸ GABRB3 P28472 2/20 0.43
▸ GABRA5 P31644 2/20 0.43
▸ GABRA3 P34903 2/20 0.43
▸ GABRA2 P47869 2/20 0.43
▸ GABRP O00591 1/20 0.43
▸ GABRD O14764 1/20 0.43
▸ GABRB1 P18505 1/20 0.43
▸ GABRB2 P47870 1/20 0.43

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
SCHEMBL15638452 0.81 ALOX5 (0.49) KMT2AMEN1MAPTRAB9ATNKS
SCHEMBL457901 0.80 ALOX5 (0.61) KMT2AMEN1MAPTRAB9ATNKS
SCHEMBL29720834 0.80 ALOX5 (0.61) KMT2AMEN1MAPTRAB9ATNKS
SCHEMBL31664386 0.80 ALOX5 (0.61) KMT2AMEN1MAPTRAB9ATNKS
SCHEMBL15638397 0.79 TNKS (0.39) KMT2AMEN1MAPTRAB9ATNKS
SCHEMBL14951324 0.79 HTR2B (0.40) KMT2AMEN1MAPTRAB9ATNKS
SCHEMBL25996710 0.77 MEN1 (0.56) KMT2AMEN1MAPTRAB9ATNKS
SCHEMBL26022356 0.77 ALOX5 (0.58) KMT2AMEN1MAPTRAB9ATNKS
SCHEMBL26536433 0.77 TNKS (0.41) KMT2AMEN1MAPTRAB9ATNKS
SCHEMBL24519169 0.77 MEN1 (0.49) KMT2AMEN1MAPTRAB9ATNKS

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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