SCHEMBL1849161

SCHEMBL1849161

CC(C)(C)OC(=O)NC1CCC(CNc2ccccc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.56
KDM1A O60341 1/20 0.55
MAOB P27338 1/20 0.55
CRHR1 P34998 2/20 0.53
DRD3 P35462 1/20 0.50
KMT2A Q03164 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
KCNA3 P22001 1/20 0.48
EPHX2 P34913 1/20 0.46
CKS1B P61024 1/20 0.45
SKP1 P63208 1/20 0.45
SKP2 Q13309 1/20 0.45
ACACB O00763 2/20 0.44
ACACA Q13085 2/20 0.44

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
SCHEMBL1849163 1.00 DRD2 (0.56) DRD2KDM1AMAOBCRHR1DRD3
SCHEMBL2390523 0.88 DRD2 (0.49) DRD2KDM1AMAOBCRHR1DRD3
SCHEMBL31206080 0.88 DRD2 (0.49) DRD2KDM1AMAOBCRHR1DRD3
SCHEMBL25039624 0.88 DRD2 (0.49) DRD2KDM1AMAOBCRHR1DRD3
SCHEMBL2390531 0.88 DRD2 (0.49) DRD2KDM1AMAOBCRHR1DRD3
SCHEMBL25039653 0.88 DRD2 (0.49) DRD2KDM1AMAOBCRHR1DRD3
SCHEMBL23826798 0.87 CRHR1 (0.54) DRD2KDM1AMAOBCRHR1DRD3
SCHEMBL23826796 0.87 CRHR1 (0.54) DRD2KDM1AMAOBCRHR1DRD3
SCHEMBL31206158 0.84 DRD2 (0.47) DRD2KDM1AMAOBCRHR1DRD3
SCHEMBL30324560 0.84 KMT2A (0.55) DRD2KDM1AMAOBDRD3KMT2A

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-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 DRD2 282/4885KDM1A 3844/4885MAOB 409/4885
US-20110152261-A1 Organic compounds CRH, CRHR1, CRHR2 DRD2 241/4885KDM1A 3961/4885MAOB 391/4885
US-20140088105-A1 Cyclohexyl Amide Derivatives and Their Use as CRF-1 Receptor Antagonists CRHR1, CRH, CRHR2 DRD2 294/4885KDM1A 2912/4885MAOB 1290/4885

“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.