SCHEMBL1397620

SCHEMBL1397620

CC(C)(C)OC(=O)CNc1cnc(Cl)cc1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 9/20 0.39
▸ ASPH Q12797 9/20 0.39
▸ KDM8 Q8N371 9/20 0.39
▸ RIOX2 Q8IUF8 8/20 0.39
▸ CCNT1 O60563 1/20 0.37
▸ STK17B O94768 1/20 0.36
▸ STK17A Q9UEE5 1/20 0.36
▸ MAPT P10636 1/20 0.35
▸ EGLN1 Q9GZT9 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ KDM4C Q9H3R0 1/20 0.34
▸ ATR Q13535 1/20 0.33
▸ CISD1 Q9NZ45 1/20 0.33
▸ LIPG Q9Y5X9 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
SCHEMBL535674 0.81 ATR (0.44) KDM4ESTK17BSTK17AATR
SCHEMBL29870494 0.81 ATR (0.44) KDM4ESTK17BSTK17AATR
SCHEMBL7374213 0.75 MAPT (0.45) KDM4EMAPT
SCHEMBL7490862 0.74 STK17B (0.48) CCNT1STK17BSTK17AMAPTL3MBTL1
SCHEMBL24342423 0.74 ATR (0.38) KDM4EATR
SCHEMBL2438709 0.74 ATR (0.38) KDM4EATR
SCHEMBL19876859 0.73 CCNT1 (0.44) CCNT1STK17BSTK17AMAPTL3MBTL1
SCHEMBL1397838 0.73 KDM4C (0.50) KDM4EASPHKDM8RIOX2MAPT
SCHEMBL15597257 0.72 CCNT1 (0.34) KDM4ECCNT1MAPTL3MBTL1LIPG
SCHEMBL5956241 0.72 KDM4E (0.56) KDM4EMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1984340-B1 ANTHRANILAMIDE/2-AMINO-HETEROARENE CARBOXAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2012-06-27 — — EP disclosed
EP-2007726-B1 BENZAMIDE AND HETEROARENE DERIVATIVES AS CETP INHIBITORS HOFFMANN LA ROCHE (CH) 2011-03-02 — — EP disclosed
US-7678818-B2 Anthranilamide and 2-amino-heteroarene-carboxamide compounds HOFFMANN-LA ROCHE INC. (US) 2010-03-16 — — US disclosed
US-7674815-B2 Heteroaryl and benzyl amide compounds HOFFMANN-LA ROCHE INC. (US) 2010-03-09 — — US disclosed
EP-2007726-A2 BENZAMIDE AND HETEROARENE DERIVATIVES AS CETP INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2008-12-31 — — EP disclosed
EP-1984340-A1 ANTHRANILAMIDE/2-AMINO-HETEROARENE CARBOXAMIDE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2008-10-29 — — EP disclosed
US-20070219261-A1 Anthranilamide and 2-amino-heteroarene-carboxamide compounds HOFFMANN-LA ROCHE INC. 2007-09-20 — — US disclosed
WO-2007090752-A1 ANTHRANILAMIDE/2-AMINO-HETEROARENE CARBOXAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-08-16 — — WO disclosed
WO-2007090749-A2 BENZAMIDE AND HETEROARENE DERIVATIVES AS CETP INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2007-08-16 — — WO disclosed
US-20070185113-A1 Heteroaryl and benzyl amide compounds HOFFMANN-LA ROCHE INC. 2007-08-09 — — 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 (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-20070219261-A1 Anthranilamide and 2-amino-heteroarene-carboxamide compounds AADAT, AAAS, AADAC KDM4E 1828/4885ASPH 39/4885KDM8 357/4885
US-20070185113-A1 Heteroaryl and benzyl amide compounds CYP2C19, CYP2C9, CYP3A43 KDM4E 2335/4885ASPH 447/4885KDM8 1932/4885

“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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