SCHEMBL22573233

SCHEMBL22573233

COc1cc2cccc(Cl)c2nc1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 3/20 0.42
▸ PDE4C Q08493 3/20 0.42
▸ PDE4D Q08499 3/20 0.42
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ NQO2 P16083 1/20 0.35
▸ NR1H2 P55055 2/20 0.35
▸ NR1H3 Q13133 2/20 0.35
▸ TRPM8 Q7Z2W7 1/20 0.35
▸ HPGD P15428 1/20 0.34
▸ SLC40A1 Q9NP59 1/20 0.34
▸ CCR4 P51679 1/20 0.34
▸ PGR P06401 1/20 0.34
▸ HPGDS O60760 1/20 0.33
▸ SLC22A12 Q96S37 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ CASP3 P42574 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ SENP8 Q96LD8 1/20 0.33

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
SCHEMBL30485653 0.84 PTGS2 (0.34) PDE4APDE4CPDE4DKMT2AHPGD
SCHEMBL22573256 0.84 PTGS2 (0.34) PDE4APDE4CPDE4DKMT2AHPGD
SCHEMBL27781348 0.75 ALDH1A1 (0.42) PDE4APDE4CPDE4DMEN1KMT2A
SCHEMBL22573236 0.73 PDE4A (0.46) PDE4APDE4CPDE4DKMT2ANR1H2
SCHEMBL12014770 0.72 NQO2 (0.46) MEN1KMT2ANQO2HPGDHPGDS
SCHEMBL31746822 0.71 NR1H2 (0.40) PDE4APDE4CPDE4DMEN1KMT2A
SCHEMBL8499741 0.70 KDM4E (0.49) HPGDNPC1
SCHEMBL15834243 0.70 PDE3B (0.35) MEN1KMT2AHPGDNPC1POLB
SCHEMBL1712822 0.70 CA2 (0.41) MEN1KMT2AHPGD
SCHEMBL27535808 0.70 DRD2 (0.42) EPAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111511719-B Novel quinoline compounds for the treatment and prevention of hepatitis b virus diseases 豪夫迈·罗氏有限公司 2023-07-14 — — CN disclosed
US-20230144399-A1 QUINOLINE COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE HOFFMANN-LA ROCHE INC. (US) 2023-05-11 — — US disclosed
US-20230144399-A1 QUINOLINE COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE HOFFMANN-LA ROCHE INC. (US) 2023-05-11 — — US disclosed
US-20230144399-A1 QUINOLINE COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE HOFFMANN-LA ROCHE INC. (US) 2023-05-11 — — US disclosed
EP-3728192-A1 NOVEL QUINOLINE COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE F. Hoffmann-La Roche AG (CH) 2020-10-28 — — EP disclosed
CN-111511719-A Quinoline compounds for the treatment and prophylaxis of hepatitis b virus diseases 豪夫迈·罗氏有限公司 2020-08-07 — — CN 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-20230144399-A1 QUINOLINE COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE RECQL, SLC10A1, UGT1A1 PDE4A 3038/4885PDE4C 2998/4885PDE4D 3729/4885

“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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