SCHEMBL12077635

SCHEMBL12077635

CCOC(C)(C)c1cc(F)c(-c2nc(C(=O)O)ccc2F)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 12/20 0.35
PIM3 Q86V86 9/20 0.35
PIM2 Q9P1W9 9/20 0.35
PRKAG1 P54619 1/20 0.34
PRKAA1 Q13131 1/20 0.34
PRKAB1 Q9Y478 1/20 0.34
ECE1 P42892 1/20 0.33
CTSA P10619 4/20 0.32
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32
KDM4E B2RXH2 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL12078610 0.88 PIM1 (0.37) PIM1PIM3PIM2CTSA
SCHEMBL12077217 0.86 PIM1 (0.38) PIM1PIM3PIM2ECE1CTSA
SCHEMBL319157 0.82 PIM1 (0.44) PIM1PIM3PIM2CTSAAKR1C3
SCHEMBL12687456 0.81 PIM1 (0.39) PIM1PIM3PIM2ECE1AKR1C3
SCHEMBL29600666 0.80 CAMKK1 (0.41) PIM1PIM3PIM2KDM4E
SCHEMBL12078221 0.80 CAMKK1 (0.41) PIM1PIM3PIM2KDM4E
SCHEMBL12079005 0.79 PIM1 (0.35) PIM1PIM3PIM2AKR1C3AKR1C2
SCHEMBL12078753 0.78 AKR1C3 (0.36) PIM1PIM3PIM2ECE1AKR1C3
SCHEMBL12697097 0.78 RXRA (0.36) PIM1PIM3PIM2PRKAG1PRKAA1
SCHEMBL18259230 0.78 PIM2 (0.41) PIM1PIM3PIM2ECE1

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
US-8431563-B2 Compounds that interact with glucokinase regulatory protein for the treatment of diabetes AMGEN INC. (US) 2013-04-30 US claimed
US-20120225854-A1 COMPOUNDS THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-09-06 US claimed
EP-2681195-A1 NOVEL KINASE INHIBITORS Novartis AG (CH) 2014-01-08 EP disclosed
US-8431563-B2 Compounds that interact with glucokinase regulatory protein for the treatment of diabetes AMGEN INC. (US) 2013-04-30 US disclosed
WO-2012120428-A1 NOVEL KINASE INHIBITORS NOVARTIS AG (CH) 2012-09-13 WO disclosed
WO-2012120428-A1 NOVEL KINASE INHIBITORS NOVARTIS AG (CH) 2012-09-13 WO disclosed
US-20120225062-A1 NOVEL KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2012-09-06 US disclosed
US-20120225062-A1 NOVEL KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2012-09-06 US disclosed
US-20120225062-A1 NOVEL KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2012-09-06 US disclosed
US-20120225854-A1 COMPOUNDS THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-09-06 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-20120225062-A1 NOVEL KINASE INHIBITORS PIM1, PIM2, PIM3 PIM1 1/4885PIM3 3/4885PIM2 2/4885
US-20120225854-A1 COMPOUNDS THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES GCKR, GCK, SLC5A2 PIM1 2184/4885PIM3 2224/4885PIM2 1154/4885

“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.