SCHEMBL23728319

SCHEMBL23728319

C[S+]([O-])c1cc(Cl)ccc1-c1cccc2c3cccc4c3n(c3cccc5c6ccccc6n4c53)c12

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.33
▸ POLB P06746 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HTT P42858 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ GSK3A P49840 2/20 0.30
▸ GSK3B P49841 2/20 0.30
▸ RGS12 O14924 1/20 0.30
▸ GMNN O75496 1/20 0.30
▸ USP2 O75604 1/20 0.30
▸ CCNB2 O95067 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CDK1 P06493 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2D6 P10635 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
SCHEMBL23723206 0.89 KDM4E (0.30) MEN1POLBMAPTHTTKMT2A
SCHEMBL25194170 0.75 KDM4E (0.34) MEN1POLBMAPTHTTKMT2A
SCHEMBL30389020 0.75 KDM4E (0.34) MEN1POLBMAPTHTTKMT2A
SCHEMBL25199578 0.74 KDM4E (0.32) MEN1POLBMAPTHTTKMT2A
SCHEMBL30388432 0.74 KDM4E (0.32) MEN1POLBMAPTHTTKMT2A
SCHEMBL23723201 0.73 MAPT (0.46) MEN1POLBMAPTHTTKMT2A
SCHEMBL24078273 0.69 KDM4E (0.47) MEN1POLBMAPTHTTKMT2A
SCHEMBL23723208 0.69 KDM4E (0.38) MEN1POLBMAPTHTTKMT2A
SCHEMBL19387982 0.68 MAPT (0.49) MEN1POLBMAPTHTTKMT2A
SCHEMBL17133804 0.68 MAPT (0.49) MEN1POLBMAPTHTTKMT2A

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-2021153931-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-08-05 — — WO disclosed
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