SCHEMBL23564313

SCHEMBL23564313

Bc1ccc2c(c1)oc1cccc(F)c12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 4/20 0.38
▸ AHR P35869 3/20 0.34
▸ HPGD P15428 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CA12 O43570 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ LMNA P02545 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ ESR1 P03372 1/20 0.31
▸ KDM5A P29375 1/20 0.31
▸ ESR2 Q92731 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
SCHEMBL29450776 0.79 AHR (0.59) ARAHRTTR
SCHEMBL21669068 0.79 AHR (0.59) ARAHRTTR
SCHEMBL24726917 0.79 ALDH1A1 (0.42) ARHPGDALDH1A1MAPTMEN1
SCHEMBL24727183 0.79 ALDH1A1 (0.59) AHRHPGDKDM4EALDH1A1MAPT
SCHEMBL23203595 0.79 TTR (0.47) AHRHPGDKDM4EALDH1A1MAPT
SCHEMBL20031833 0.78 MAPT (0.39) AHRHPGDKDM4EALDH1A1MAPT
SCHEMBL24662745 0.78 AHR (0.48) AHRHPGDKDM4EALDH1A1MAPT
SCHEMBL23564504 0.77 DYRK1A (0.38) AHRHPGDKDM4EALDH1A1MAPT
SCHEMBL7110353 0.77 HPGD (0.48) ARAHRHPGDKDM4EALDH1A1
SCHEMBL24564907 0.76 MAPT (0.50) AHRHPGDKDM4EALDH1A1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4019513-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING SAME LG Chem, Ltd. (KR) 2022-06-29 — — EP disclosed
WO-2021125552-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING SAME 주식회사 엘지화학 2021-06-24 — — WO disclosed
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