SCHEMBL14653493

SCHEMBL14653493

Bc1ccc2[nH]c3ccc4c5ccccc5sc4c3c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNKS O95271 2/20 0.46
▸ TNKS2 Q9H2K2 2/20 0.46
▸ MAPT P10636 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ RAB9A P51151 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
▸ GABRG1 Q8N1C3 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
SCHEMBL29520199 0.88 TNKS (0.57) TNKSTNKS2MAPTMEN1KMT2A
SCHEMBL31684 0.88 TNKS (0.57) TNKSTNKS2MAPTMEN1KMT2A
SCHEMBL29470199 0.88 TNKS (0.57) TNKSTNKS2MAPTMEN1KMT2A
SCHEMBL16919355 0.83 MAPT (0.50) TNKSTNKS2MAPTMEN1KMT2A
SCHEMBL18630464 0.83 MAPT (0.43) TNKSTNKS2MAPTMEN1KMT2A
SCHEMBL4554410 0.83 KDM4E (0.44) TNKSTNKS2MAPTMEN1KMT2A
SCHEMBL21656101 0.83 KIF11 (0.49) TNKSTNKS2MAPTMEN1KMT2A
SCHEMBL8817511 0.83 GABRP (0.45) TNKSTNKS2MAPTMEN1KMT2A
SCHEMBL30104215 0.82 CDK4 (0.49) TNKSTNKS2MAPTMEN1KMT2A
SCHEMBL14652763 0.82 CDK4 (0.49) TNKSTNKS2MAPTMEN1KMT2A

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-2013012296-A1 NOVEL ORGANIC ELECTROLUMINESCENCE COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2013-01-24 — — WO disclosed
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