SCHEMBL10330207

SCHEMBL10330207

CC(C)(C)OCCC1COCCN1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
MKNK1 Q9BUB5 2/20 0.32
CNR2 P34972 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
SCHEMBL15055613 0.82 ALDH1A1 (0.44) ALDH1A1CNR2
SCHEMBL12395701 0.82 ALDH1A1 (0.44) ALDH1A1CNR2
SCHEMBL24532573 0.80 MKNK1 (0.33) MKNK1
SCHEMBL2911469 0.80 MKNK1 (0.33) MKNK1
Hydrochloric Acid SCHEMBL29091022 0.79 MKNK1 (0.33) MKNK1
Hydrochloric Acid SCHEMBL29091021 0.79 MKNK1 (0.33) MKNK1
SCHEMBL10330625 0.77 MKNK1 (0.32) ALDH1A1MKNK1
SCHEMBL15496990 0.77 PLG (0.38) CNR2
SCHEMBL14275282 0.76 IRAK4 (0.33) MKNK1
SCHEMBL29318379 0.75 MKNK1 (0.33) MKNK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120277434-A1 METHODS FOR SYNTHESIZING QUINOLINONE COMPOUNDS CAI SHAOPEI (US) 2012-11-01 US disclosed
US-8299081-B2 Methods for treating drug resistant cancer NOVARTIS AG (CH) 2012-10-30 US disclosed
US-8222413-B2 Methods for synthesizing heterocyclic compounds NOVARTIS AG (US) 2012-07-17 US disclosed
US-20110046376-A1 METHODS FOR SYNTHESIZING HETEROCYCLIC COMPOUNDS. NOVARTIS AG (CH) 2011-02-24 US disclosed
US-7825132-B2 Inhibition of FGFR3 and treatment of multiple myeloma NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-11-02 US disclosed
US-20100184754-A1 QUINOLINONE DERIVATIVES NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2010-07-22 US disclosed
US-20100184754-A1 QUINOLINONE DERIVATIVES NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2010-07-22 US disclosed
US-20090281100-A1 Benzimidazole quinolinones and uses thereof BARSANTI PAUL A 2009-11-12 US disclosed
US-7598268-B2 Quinolinone derivatives NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2009-10-06 US disclosed
US-7598268-B2 Quinolinone derivatives NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2009-10-06 US disclosed
US-20090215793-A1 Methods for treating drug resistant cancer NOVARTIS AG 2009-08-27 US disclosed
US-7470709-B2 Benzimidazole quinolinones and uses thereof NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-12-30 US disclosed
US-7368459-B2 Heterocyclic compounds CHIRON CORPORATION (US) 2008-05-06 US disclosed
US-20080070906-A1 QUINOLINONE DERIVATIVES NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2008-03-20 US disclosed
US-7335774-B2 Quinolinone derivatives NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-02-26 US disclosed
US-7335774-B2 Quinolinone derivatives NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-02-26 US disclosed
US-20070032528-A1 Heterocyclic compounds RENHOWE PAUL A 2007-02-08 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 (7 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-20080070906-A1 QUINOLINONE DERIVATIVES SLCO1B1, SLCO1B3, SLCO1A2 ALDH1A1 274/4885MKNK1 4561/4885CNR2 898/4885
US-20070032528-A1 Heterocyclic compounds SLCO4C1, SLCO2B1, SLCO1B1 ALDH1A1 1573/4885MKNK1 4227/4885CNR2 390/4885
US-20120277434-A1 METHODS FOR SYNTHESIZING QUINOLINONE COMPOUNDS KCNJ2, KCNQ2, KCNJ11 ALDH1A1 1983/4885MKNK1 648/4885CNR2 2451/4885
US-20110046376-A1 METHODS FOR SYNTHESIZING HETEROCYCLIC COMPOUNDS. NISCH, DOHH, DNPH1 ALDH1A1 1964/4885MKNK1 1307/4885CNR2 370/4885
US-20090281100-A1 Benzimidazole quinolinones and uses thereof GAA, ALPI, IL4I1 ALDH1A1 276/4885MKNK1 3605/4885CNR2 3723/4885
US-20100184754-A1 QUINOLINONE DERIVATIVES SLCO1B1, SLCO1B3, SLCO1A2 ALDH1A1 274/4885MKNK1 4561/4885CNR2 898/4885
US-20090215793-A1 Methods for treating drug resistant cancer ABCC1, SLC11A2, SLC10A1 ALDH1A1 1015/4885MKNK1 681/4885CNR2 4588/4885

“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.