SCHEMBL23299598

SCHEMBL23299598

O=Cc1cc(O)cc2c(=O)cc(-c3ccc(O)cc3)oc12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 3/20 0.68
▸ ESR2 Q92731 3/20 0.68
▸ CSNK2A2 P19784 5/20 0.57
▸ CSNK2B P67870 5/20 0.57
▸ CSNK2A1 P68400 5/20 0.57
▸ MAPT P10636 5/20 0.56
▸ SMN1; SMN2 Q16637 4/20 0.56
▸ CYP3A4 P08684 4/20 0.56
▸ HPGD P15428 4/20 0.56
▸ NPC1 O15118 4/20 0.56
▸ IP6K2 Q9UHH9 3/20 0.56
▸ RAB9A P51151 3/20 0.56
▸ TP53 P04637 3/20 0.56
▸ LMNA P02545 2/20 0.56
▸ THRB P10828 2/20 0.56
▸ ALOX15 P16050 2/20 0.56
▸ CASP3 P42574 1/20 0.56
▸ SENP8 Q96LD8 1/20 0.56
▸ SENP7 Q9BQF6 1/20 0.56
▸ SENP6 Q9GZR1 1/20 0.56

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
SCHEMBL10305796 0.82 TERT (0.66) ESR1ESR2CSNK2A2CSNK2BCSNK2A1
SCHEMBL3930656 0.81 ESR1 (1.00) ESR1ESR2CSNK2A2CSNK2BCSNK2A1
SCHEMBL13355967 0.76 CYP1A1 (0.70) ESR1ESR2CSNK2A2CSNK2BCSNK2A1
SCHEMBL5309179 0.75 TERT (0.73) CSNK2A2CSNK2BCSNK2A1MAPTSMN1; SMN2
SCHEMBL24046928 0.72 CSNK2A2 (0.65) ESR1ESR2CSNK2A2CSNK2BCSNK2A1
SCHEMBL15231415 0.72 CSNK2A2 (0.65) ESR1ESR2CSNK2A2CSNK2BCSNK2A1
SCHEMBL31741263 0.72 MAPT (1.00) ESR2CSNK2A2CSNK2BCSNK2A1MAPT
SCHEMBL311405 0.72 MAPT (1.00) ESR2CSNK2A2CSNK2BCSNK2A1MAPT
SCHEMBL311865 0.72 TERT (0.68) CSNK2A2CSNK2BCSNK2A1MAPTSMN1; SMN2
SCHEMBL4649959 0.72 TERT (1.00) CSNK2A2CSNK2BCSNK2A1MAPTSMN1; SMN2

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-2021081429-A1 APIGENIN GLYCOSIDES FLAVOR ENHANCERS OHIO STATE INNOVATION FOUNDATION (US) 2021-04-29 — — WO disclosed
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