SCHEMBL2066745

SCHEMBL2066745

CC1(C)OB(c2cncc(OC(CF)CF)c2)OC1(C)C

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 1/20 0.36
FFAR1 O14842 1/20 0.33
LPL P06858 6/20 0.33
LIPG Q9Y5X9 6/20 0.33
DGAT1 O75907 2/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
F11 P03951 1/20 0.31
GSK3A P49840 1/20 0.30
GSK3B P49841 1/20 0.30
SNCA P37840 1/20 0.30

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
SCHEMBL2067468 0.84 AAK1 (0.38) AAK1FFAR1LPLLIPGDGAT1
SCHEMBL29990311 0.84 AAK1 (0.38) AAK1FFAR1LPLLIPGDGAT1
SCHEMBL112806 0.82 AAK1 (0.36) AAK1FFAR1LPLLIPGDGAT1
SCHEMBL31651716 0.82 AAK1 (0.36) AAK1FFAR1LPLLIPGDGAT1
SCHEMBL4171200 0.80 AAK1 (0.35) AAK1FFAR1LPLLIPGDGAT1
SCHEMBL3515502 0.79 AAK1 (0.37) AAK1FFAR1LPLLIPGDGAT1
SCHEMBL24587314 0.78 AAK1 (0.41) AAK1FFAR1LPLLIPGDGAT1
SCHEMBL16052301 0.77 LPL (0.40) AAK1FFAR1LPLLIPGDGAT1
SCHEMBL29487604 0.77 SNCA (0.42) AAK1FFAR1LPLLIPGDGAT1
SCHEMBL182869 0.77 SNCA (0.42) AAK1FFAR1LPLLIPGDGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140005163-A1 1H-IMIDAZO[4,5-C]QUINOLINONE DERIVATIVES NOVARTIS AG (CH) 2014-01-02 US disclosed
US-8476294-B2 1H-imidazo[4,5-c]quinolinone derivatives NOVARTIS AG (CH) 2013-07-02 US disclosed
US-8476294-B2 1H-imidazo[4,5-c]quinolinone derivatives NOVARTIS AG (CH) 2013-07-02 US disclosed
US-8476294-B2 1H-imidazo[4,5-c]quinolinone derivatives NOVARTIS AG (CH) 2013-07-02 US disclosed
EP-2438064-A1 1H-IMIDAZO[4,5-c]QUINOLINONE DERIVATIVES Novartis AG (CH) 2012-04-11 EP disclosed
US-20100317657-A1 1H-IMIDAZO[4,5-c]QUINOLINONE DERIVATIVES NOVARTIS AG 2010-12-16 US disclosed
US-20100317657-A1 1H-IMIDAZO[4,5-c]QUINOLINONE DERIVATIVES NOVARTIS AG 2010-12-16 US disclosed
WO-2010139731-A1 1H-IMIDAZO[4,5-c]QUINOLINONE DERIVATIVES NOVARTIS AG (CH) 2010-12-09 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-20100317657-A1 1H-IMIDAZO[4,5-c]QUINOLINONE DERIVATIVES PRKCA, CSNK1A1, ABL1 AAK1 136/4885FFAR1 940/4885LPL 739/4885
US-20140005163-A1 1H-IMIDAZO[4,5-C]QUINOLINONE DERIVATIVES PRKCA, CSNK1A1, ABL1 AAK1 136/4885FFAR1 940/4885LPL 739/4885

“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.