SCHEMBL29929667

SCHEMBL29929667

COc1cc(-c2cc(=O)c3ccc(O)cc3o2)ccc1O

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A2 P19784 11/20 0.81
▸ CSNK2B P67870 11/20 0.81
▸ CSNK2A1 P68400 11/20 0.81
▸ ESR2 Q92731 1/20 0.81
▸ MEN1 O00255 5/20 0.75
▸ KMT2A Q03164 5/20 0.75
▸ CYP3A4 P08684 5/20 0.75
▸ MAPT P10636 4/20 0.75
▸ KDM4E B2RXH2 4/20 0.75
▸ HPGD P15428 4/20 0.75
▸ CYP2C9 P11712 3/20 0.75
▸ CYP2C19 P33261 3/20 0.75
▸ MAPK1 P28482 3/20 0.75
▸ SMN1; SMN2 Q16637 3/20 0.75
▸ POLB P06746 2/20 0.75
▸ CYP2D6 P10635 2/20 0.75
▸ PABPC1 P11940 1/20 0.75
▸ RAB9A P51151 1/20 0.75
▸ CREBBP Q92793 1/20 0.75
▸ TNKS O95271 2/20 0.71

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
SCHEMBL9663466 1.00 CSNK2A2 (0.81) CSNK2A2CSNK2BCSNK2A1ESR2MEN1
SCHEMBL29435862 1.00 CSNK2A2 (0.81) CSNK2A2CSNK2BCSNK2A1ESR2MEN1
SCHEMBL9663461 0.93 CSNK2A2 (0.87) CSNK2A2CSNK2BCSNK2A1ESR2MEN1
SCHEMBL4400168 0.91 FYN (0.81) CSNK2A2CSNK2BCSNK2A1ESR2MEN1
SCHEMBL10052259 0.90 CSNK2A2 (1.00) CSNK2A2CSNK2BCSNK2A1ESR2MEN1
SCHEMBL30960382 0.90 TNKS (0.71) CSNK2A2CSNK2BCSNK2A1ESR2MEN1
SCHEMBL1744293 0.90 TNKS (0.71) CSNK2A2CSNK2BCSNK2A1ESR2MEN1
SCHEMBL31740082 0.86 CSNK2A2 (1.00) CSNK2A2CSNK2BCSNK2A1ESR2MEN1
SCHEMBL312071 0.86 CSNK2A2 (1.00) CSNK2A2CSNK2BCSNK2A1ESR2MEN1
SCHEMBL31362003 0.86 CSNK2A2 (1.00) CSNK2A2CSNK2BCSNK2A1ESR2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023064318-A1 BIPHASIC COMPOSITIONS COMPRISING ONE OR BOTH OF CARBONATE AND PHOSPHATE Natural Extraction Systems, LLC (US) 2023-04-20 — — WO claimed
WO-2022182527-A1 COMPOSITIONS AND METHODS RELATED TO PHARMACEUTICAL EXCIPIENTS Natural Extraction Systems, LLC (US) 2022-09-01 — — WO claimed
WO-2023064318-A1 BIPHASIC COMPOSITIONS COMPRISING ONE OR BOTH OF CARBONATE AND PHOSPHATE Natural Extraction Systems, LLC (US) 2023-04-20 — — WO disclosed
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