SCHEMBL23564151

SCHEMBL23564151

CC(C)(O)C(C)(C)OBc1ccc2c(c1)oc1c(Cl)cc(Cl)cc12

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AHR P35869 14/20 0.43
CSNK2A2 P19784 1/20 0.31
CSNK2B P67870 1/20 0.31
CSNK2A1 P68400 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
SCHEMBL23948012 0.86 TTR (0.39) AHR
SCHEMBL23948019 0.84 AHR (0.44) AHR
SCHEMBL22986636 0.84 AHR (0.46) AHR
SCHEMBL21968791 0.78 AHR (0.41) AHR
SCHEMBL23299472 0.78 AHR (0.40) AHRCSNK2A2CSNK2BCSNK2A1
SCHEMBL23098286 0.76 GGPS1 (0.31)
SCHEMBL19660360 0.75 KDM4E (0.35) CSNK2A2CSNK2BCSNK2A1
SCHEMBL22057975 0.74 AHR (0.37) AHR
SCHEMBL24030821 0.74 DYRK1A (0.33) AHR
SCHEMBL23987485 0.74 KMT2A (0.34) AHR

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