SCHEMBL21801314

SCHEMBL21801314

O=c1cc(-c2ccc(O)cc2)oc2c(Cl)cc(Br)cc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A2 P19784 7/20 0.56
▸ CSNK2B P67870 7/20 0.56
▸ CSNK2A1 P68400 7/20 0.56
▸ TERT O14746 2/20 0.55
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ KDM4E B2RXH2 3/20 0.51
▸ CYP3A4 P08684 2/20 0.51
▸ HPGD P15428 2/20 0.51
▸ IP6K2 Q9UHH9 2/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ MAPT P10636 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ MPO P05164 1/20 0.51
▸ CYP19A1 P11511 1/20 0.51
▸ MAOA P21397 1/20 0.51
▸ MAOB P27338 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ QPCT Q16769 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51

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
SCHEMBL15231415 0.86 CSNK2A2 (0.65) CSNK2A2CSNK2BCSNK2A1TERTSMN1; SMN2
SCHEMBL24046928 0.86 CSNK2A2 (0.65) CSNK2A2CSNK2BCSNK2A1TERTSMN1; SMN2
SCHEMBL21801147 0.83 GABRP (0.63) CSNK2A2CSNK2BCSNK2A1SMN1; SMN2KDM4E
SCHEMBL21801263 0.80 CSNK2A2 (0.52) CSNK2A2CSNK2BCSNK2A1TERTSMN1; SMN2
SCHEMBL21801095 0.80 TDP1 (0.64) CSNK2A2CSNK2BCSNK2A1TERTSMN1; SMN2
SCHEMBL29180249 0.79 PTGES (0.43) CSNK2A2CSNK2BCSNK2A1TERTSMN1; SMN2
SCHEMBL30744111 0.78 TERT (0.62) CSNK2A2CSNK2BCSNK2A1TERTSMN1; SMN2
SCHEMBL21801175 0.78 TERT (0.62) CSNK2A2CSNK2BCSNK2A1TERTSMN1; SMN2
SCHEMBL4649432 0.77 CSNK2A2 (0.58) CSNK2A2CSNK2BCSNK2A1CYP1A1CYP1A2
SCHEMBL5085541 0.76 ERAP1 (0.47) KDM4EHPGDNPC1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12012390-B2 Flavone compounds for the treatment and prophylaxis of hepatitis B virus disease HOFFMANN-LA ROCHE INC. (US) 2024-06-18 — — US disclosed
CN-112601743-B Flavone compounds for the treatment and prevention of hepatitis b virus diseases 豪夫迈·罗氏有限公司 2023-12-19 — — CN disclosed
EP-3849966-B1 FLAVONE COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE HOFFMANN LA ROCHE (CH) 2023-10-25 — — EP disclosed
EP-3849966-B1 FLAVONE COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE HOFFMANN LA ROCHE (CH) 2023-10-25 — — EP disclosed
US-20220363657-A1 FLAVONE COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE HOFFMANN-LA ROCHE INC. (US) 2022-11-17 — — US disclosed
EP-3849966-A1 FLAVONE COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE F. Hoffmann-La Roche AG (CH) 2021-07-21 — — EP disclosed
CN-112601743-A Flavone compounds for treating and preventing hepatitis B virus diseases 豪夫迈·罗氏有限公司 2021-04-02 — — CN disclosed
WO-2020052774-A1 FLAVONE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2020-03-19 — — WO disclosed
WO-2020052774-A1 FLAVONE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2020-03-19 — — WO disclosed
WO-2020053249-A1 FLAVONE COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2020-03-19 — — WO disclosed
WO-2020053249-A1 FLAVONE COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2020-03-19 — — WO 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 (2 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-12012390-B2 Flavone compounds for the treatment and prophylaxis of hepatitis B virus disease PCNA, DNMT1, DNMT3B CSNK2A2 3955/4885CSNK2B 3669/4885CSNK2A1 3802/4885
US-20220363657-A1 FLAVONE COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE PCNA, DNMT1, DNMT3B CSNK2A2 3955/4885CSNK2B 3669/4885CSNK2A1 3802/4885

“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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