SCHEMBL25890837

SCHEMBL25890837

CC(C)(C)c1ccc(N(c2cccc3c2oc2ccccc23)c2ccc(N(c3ccccc3)c3ccccc3)c3c2oc2ccccc23)cc1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
CYP2C19 P33261 1/20 0.31
CDC14B O60729 1/20 0.30
CDC14A Q9UNH5 1/20 0.30
PRSS1 P07477 1/20 0.30
ALOX5 P09917 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
SCHEMBL15746008 0.92 MEN1 (0.35) KEAP1NFE2L2MEN1KMT2ACYP2C19
SCHEMBL25890723 0.86 ALOX5 (0.36) MEN1KMT2ACDC14BCDC14AALOX5
SCHEMBL14295583 0.86 ALOX5 (0.37) MEN1KMT2ACYP2C19ALOX5
SCHEMBL24734800 0.85 MEN1 (0.36) KEAP1NFE2L2MEN1KMT2ACDC14B
SCHEMBL23278353 0.84 MEN1 (0.31) KEAP1NFE2L2MEN1KMT2ACYP2C19
SCHEMBL21019183 0.84
SCHEMBL27252693 0.83 ALOX5 (0.35) MEN1KMT2AALOX5
SCHEMBL27290087 0.83 AHR (0.34) MEN1KMT2ACDC14BCDC14A
SCHEMBL25749540 0.83 CYP2C19 (0.34) MEN1KMT2ACYP2C19ALOX5
SCHEMBL21019343 0.83 HPGD (0.30)

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-2023140528-A1 ORGANIC ELECTRIC ELEMENT USING COMPOUND FOR ORGANIC ELECTRIC ELEMENT, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-07-27 WO disclosed