SCHEMBL2363734

SCHEMBL2363734

CCc1cc(CC)n(C[C@H]2CC[C@H](N)CC2)n1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 3/20 0.47
SMYD3 Q9H7B4 1/20 0.42
MERTK Q12866 12/20 0.38
AXL P30530 4/20 0.36
TYRO3 Q06418 4/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAPT P10636 1/20 0.35
BRD4 O60885 1/20 0.34

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
SCHEMBL2363732 1.00 CRHR1 (0.47) CRHR1SMYD3MERTKAXLTYRO3
Hydrochloric Acid SCHEMBL14150158 0.98 CRHR1 (0.47) CRHR1SMYD3MERTKAXLTYRO3
Hydrochloric Acid SCHEMBL14150159 0.98 CRHR1 (0.47) CRHR1SMYD3MERTKAXLTYRO3
Hydrochloric Acid SCHEMBL2364863 0.79 CRHR1 (0.52) CRHR1SMYD3
SCHEMBL27877442 0.75 CRHR1 (0.46) CRHR1SMYD3ALDH1A1LMNAL3MBTL1
SCHEMBL27877441 0.75 CRHR1 (0.46) CRHR1SMYD3ALDH1A1LMNAL3MBTL1
SCHEMBL2323151 0.71 CRHR1 (0.56) CRHR1SMYD3L3MBTL1
SCHEMBL27877443 0.71 CRHR1 (0.49) CRHR1
SCHEMBL10193114 0.69 CA12 (0.40) CRHR1
SCHEMBL6357438 0.66 CA12 (0.35) CRHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102753527-B Cyclohexyl amide derivatives as crf receptor antagonists NOVARTIS AG 2014-12-24 CN disclosed
EP-2531490-B1 CYCLOHEXYL AMIDE DERIVATIVES AS CRF RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2014-10-15 EP disclosed
US-8835444-B2 Cyclohexyl amide derivatives as CRF receptor antagonists NOVARTIS AG (CH) 2014-09-16 US disclosed
US-8835444-B2 Cyclohexyl amide derivatives as CRF receptor antagonists NOVARTIS AG (CH) 2014-09-16 US disclosed
US-8835444-B2 Cyclohexyl amide derivatives as CRF receptor antagonists NOVARTIS AG (CH) 2014-09-16 US disclosed
US-20120316185-A1 Cyclohexyl Amide Derivatives as CRF Receptor Antagonists NOVARTIS AG (CH) 2012-12-13 US disclosed
US-20120316185-A1 Cyclohexyl Amide Derivatives as CRF Receptor Antagonists NOVARTIS AG (CH) 2012-12-13 US disclosed
US-20120316185-A1 Cyclohexyl Amide Derivatives as CRF Receptor Antagonists NOVARTIS AG (CH) 2012-12-13 US disclosed
EP-2531490-A1 CYCLOHEXYL AMIDE DERIVATIVES AS CRF RECEPTOR ANTAGONISTS Novartis AG (CH) 2012-12-12 EP disclosed
CN-102753527-A Cyclohexyl amide derivatives as crf receptor antagonists NOVARTIS AG 2012-10-24 CN disclosed
WO-2011095450-A1 CYCLOHEXYL AMIDE DERIVATIVES AS CRF RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2011-08-11 WO disclosed
WO-2011095450-A1 CYCLOHEXYL AMIDE DERIVATIVES AS CRF RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2011-08-11 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 (1 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-20120316185-A1 Cyclohexyl Amide Derivatives as CRF Receptor Antagonists CRHR2, CRHR1, CRH CRHR1 2/4885SMYD3 4541/4885MERTK 2947/4885

“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.