SCHEMBL20650863

SCHEMBL20650863

C1=Cc2c(c(-c3cccc4c3sc3ccccc34)c3ccccc3c2-c2ccc(-c3ccccc3)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.41
▸ PARP14 Q460N5 1/20 0.34
▸ PRKDC P78527 6/20 0.32
▸ TNKS O95271 1/20 0.31
▸ TNKS2 Q9H2K2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ PIK3CD O00329 2/20 0.30
▸ PIK3CB P42338 2/20 0.30
▸ BRD4 O60885 1/20 0.30
▸ PIK3CA P42336 1/20 0.30
▸ MTOR P42345 1/20 0.30
▸ PIK3CG P48736 1/20 0.30
▸ KCNH2 Q12809 1/20 0.30
▸ BRDT Q58F21 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL23719569 0.91 ALOX5 (0.40) ALOX5PARP14PRKDCTNKSTNKS2
SCHEMBL21587173 0.90 ALOX5 (0.38) ALOX5PARP14PRKDCTNKSTNKS2
SCHEMBL23719453 0.89 ALOX5 (0.36) ALOX5PARP14
SCHEMBL23719574 0.85 ALOX5 (0.30) ALOX5
SCHEMBL23719956 0.84 ALOX5 (0.34) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL22293395 0.84 BRDT (0.31) BRDT
SCHEMBL23719873 0.84 ALOX5 (0.33) ALOX5PRKDC
SCHEMBL23472872 0.83 ALOX5 (0.33) ALOX5PRKDC
SCHEMBL22293509 0.83 ALOX5 (0.40) ALOX5PARP14PRKDCPIK3CDPIK3CB
SCHEMBL22293492 0.82 ALOX5 (0.34) ALOX5PRKDC

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
EP-3428152-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME LG Chem, Ltd. (KR) 2019-01-16 — — EP disclosed
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