SCHEMBL23719595

SCHEMBL23719595

C1=Cc2c(c(-c3cccc4sc5cccc(-c6c7ccccc7c(-c7ccccc7)c7ccccc67)c5c34)c3ccccc3c2-c2ccsc2)CC1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ CYP2E1 P05181 1/20 0.31
▸ CYP2A6 P11509 1/20 0.31
▸ CYP2B6 P20813 1/20 0.31

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
SCHEMBL22293395 0.86 BRDT (0.31) —
SCHEMBL23428109 0.83 MEN1 (0.48) MEN1HSP90AA1KMT2ATDP1L3MBTL1
SCHEMBL23719698 0.81 — —
SCHEMBL23472800 0.81 PRKDC (0.32) —
SCHEMBL23719574 0.81 ALOX5 (0.30) —
SCHEMBL23719453 0.80 ALOX5 (0.36) —
SCHEMBL23719577 0.78 PRKDC (0.30) CYP2E1CYP2A6CYP2B6
SCHEMBL20650863 0.78 ALOX5 (0.41) MEN1KMT2AL3MBTL1
SCHEMBL23428167 0.76 MEN1 (0.41) MEN1HSP90AA1KMT2ATDP1L3MBTL1
SCHEMBL23426882 0.76 MEN1 (0.41) MEN1HSP90AA1KMT2ATDP1L3MBTL1

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-3859812-A1 ORGANIC LIGHT-EMITTING DEVICE Samsung Electronics Co., Ltd. (KR) 2021-08-04 — — EP disclosed
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