SCHEMBL1849400

SCHEMBL1849400

Cc1nn(CC2CCC(NC(=O)OC(C)(C)C)CC2)c(C)c1C

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 7/20 0.54
DRD2 P14416 7/20 0.49
DRD3 P35462 1/20 0.41
KDM1A O60341 1/20 0.39
MAOB P27338 1/20 0.39
CKS1B P61024 1/20 0.39
SKP1 P63208 1/20 0.39
SKP2 Q13309 1/20 0.39
CTSK P43235 2/20 0.38
BTK Q06187 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL1849402 1.00 CRHR1 (0.54) CRHR1DRD2DRD3KDM1AMAOB
SCHEMBL17685467 0.77 CRHR1 (0.51) CRHR1DRD2
SCHEMBL17685468 0.77 CRHR1 (0.51) CRHR1DRD2
SCHEMBL2323148 0.76 CRHR1 (0.56) CRHR1DRD2DRD3KDM1AMAOB
SCHEMBL2323151 0.76 CRHR1 (0.56) CRHR1DRD2DRD3KDM1AMAOB
SCHEMBL13696451 0.76 CRHR1 (0.49) CRHR1KMT2AL3MBTL1
SCHEMBL12501447 0.73 DRD2 (0.62) DRD2DRD3CTSKBTKKMT2A
SCHEMBL14651348 0.73 DRD2 (0.62) DRD2DRD3CTSKBTKKMT2A
SCHEMBL20865563 0.73 BTK (0.51) DRD2DRD3KDM1AMAOBCTSK
SCHEMBL2483799 0.72 DRD2 (0.61) DRD2DRD3CTSKBTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2323970-B1 CYCLOHEXYL AMIDE DERIVATIVES AND THEIR USE AS CRF-1 RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2016-04-20 EP disclosed
US-20140088105-A1 Cyclohexyl Amide Derivatives and Their Use as CRF-1 Receptor Antagonists NOVARTIS AG (CH) 2014-03-27 US disclosed
US-8614213-B2 Cyclohexyl amide derivatives and their use as CRF-1 receptor antagonists NOVARTIS AG (CH) 2013-12-24 US disclosed
US-8273900-B2 Organic compounds NOVARTIS AG (CH) 2012-09-25 US disclosed
CN-102143940-A Cyclohexyl amide derivatives as CRF-1 receptor antagonists and uses thereof NOVARTIS AG 2011-08-03 CN disclosed
US-20110152261-A1 Organic compounds NOVARTIS AG (CH) 2011-06-23 US disclosed
EP-2323970-A1 CYCLOHEXYL AMIDE DERIVATIVES AND THEIR USE AS CRF-1 RECEPTOR ANTAGONISTS Novartis AG (CH) 2011-05-25 EP disclosed
WO-2010015655-A1 CYCLOHEXYL AMIDE DERIVATIVES AND THEIR USE AS CRF-1 RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2010-02-11 WO disclosed
US-20100035898-A1 Organic compounds NOVARTIS AG (CH) 2010-02-11 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 (3 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-20100035898-A1 Organic compounds CRH, CRHR1, CRHR2 CRHR1 2/4885DRD2 282/4885DRD3 285/4885
US-20110152261-A1 Organic compounds CRH, CRHR1, CRHR2 CRHR1 2/4885DRD2 241/4885DRD3 237/4885
US-20140088105-A1 Cyclohexyl Amide Derivatives and Their Use as CRF-1 Receptor Antagonists CRHR1, CRH, CRHR2 CRHR1 1/4885DRD2 294/4885DRD3 353/4885

“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.