SCHEMBL22965202

SCHEMBL22965202

COc1ccc(C2(O)COc3c(ccc4c3CCC(C)(C)O4)C2O)c(OS(=O)(=O)c2ccc(C)cc2)c1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 4/20 0.37
▸ HSP90AA1 P07900 2/20 0.34
▸ CNR1 P21554 3/20 0.33
▸ CNR2 P34972 3/20 0.33
▸ MAPT P10636 2/20 0.33
▸ PLCG2 P16885 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ MALT1 Q9UDY8 2/20 0.32
▸ GFER P55789 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
SCHEMBL22965236 0.89 CNR1 (0.38) PTPN1HSP90AA1CNR1CNR2MAPT
SCHEMBL21454602 0.82 MALT1 (0.37) PTPN1HSP90AA1CNR2MAPTPLCG2
SCHEMBL22965225 0.81 PTPN1 (0.47) PTPN1HSP90AA1
SCHEMBL21454558 0.81 CNR1 (0.38) PTPN1HSP90AA1CNR1CNR2MAPT
SCHEMBL22965224 0.77 PTPN1 (0.37) PTPN1
SCHEMBL22965205 0.75 MALT1 (0.37) PTPN1HSP90AA1CNR2MAPTPLCG2
SCHEMBL22965252 0.73 PTPN1 (0.43) PTPN1HSP90AA1
SCHEMBL21454331 0.73 CNR2 (0.35) PTPN1HSP90AA1CNR1CNR2
SCHEMBL23017896 0.69 CNR2 (0.33) PTPN1HSP90AA1CNR1CNR2
SCHEMBL22947214 0.67 HSP90AA1 (0.42) HSP90AA1MAPTPLCG2KDM4EALDH1A1

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
US-20210040106-A1 METHOD FOR SYNTHESIZING 3-PHENYL-2,8-DIHYDROPYRANO [2,3-F] CHROMENE DERIVATIVE Glaceum Inc. (KR) 2021-02-11 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210040106-A1 METHOD FOR SYNTHESIZING 3-PHENYL-2,8-DIHYDROPYRANO [2,3-F] CHROMENE DERIVATIVE HPD, CYP2J2, PAH PTPN1 2837/4885HSP90AA1 3318/4885CNR1 1750/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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