SCHEMBL26462014

SCHEMBL26462014

Brc1c2ccccc2c2c3c(cccc13)-c1ccccc1-c1ccccc1-2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HKDC1 Q2TB90 1/20 0.43
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
ALDH1A1 P00352 4/20 0.39
TSHR P16473 3/20 0.39
MAPK1 P28482 3/20 0.39
HSD17B10 Q99714 3/20 0.39
CASP1 P29466 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
HPGD P15428 2/20 0.39
HIF1A Q16665 2/20 0.39
ATM Q13315 1/20 0.39
PABPC1 P11940 3/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP1A2 P05177 2/20 0.33
ANPEP P15144 1/20 0.33

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
SCHEMBL762145 1.00 HKDC1 (0.43) HKDC1CRHBPCRHR2KEAP1NFE2L2
SCHEMBL762147 0.86 PTPRC (0.41) HKDC1CRHBPCRHR2KEAP1NFE2L2
SCHEMBL14134081 0.83 ALDH1A1 (0.52) HKDC1CRHBPCRHR2KEAP1NFE2L2
SCHEMBL701595 0.82 ALDH1A1 (0.35) HKDC1CRHBPCRHR2KEAP1NFE2L2
SCHEMBL28912042 0.82 L3MBTL1 (0.44) HKDC1CRHBPCRHR2KEAP1NFE2L2
SCHEMBL3183695 0.79 CES1 (0.54) ALDH1A1MAPK1CASP1L3MBTL1PABPC1
SCHEMBL28517525 0.78 DNMT1 (0.40) KEAP1ALDH1A1TSHRMAPK1HSD17B10
SCHEMBL4762276 0.77 CRHBP (0.50) HKDC1CRHBPCRHR2KEAP1NFE2L2
SCHEMBL22605624 0.76 TYMS (0.46) HKDC1TSHRCES1
SCHEMBL31037900 0.76 TYMS (0.46) HKDC1TSHRCES1

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-2023065996-A1 ANTHRACENE DERIVATIVE, ORGANIC ELECTROLUMINESCENT MATERIAL, LIGHT-EMITTING DEVICE, AND CONSUMER PRODUCT 上海八亿时空先进材料有限公司 2023-04-27 WO disclosed