SCHEMBL2272829

SCHEMBL2272829

Cc1cnc2c(c1)[nH]c(=O)n2C

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.69
MEN1 O00255 2/20 0.69
KMT2A Q03164 2/20 0.69
PABPC1 P11940 1/20 0.69
PDE3B Q13370 5/20 0.48
PDE3A Q14432 5/20 0.48
DAO P14920 2/20 0.42
CYP3A4 P08684 1/20 0.42
MAPK1 P28482 1/20 0.42
PMP22 Q01453 1/20 0.42
KDM4E B2RXH2 2/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
HSD17B10 Q99714 1/20 0.40
KDM4A O75164 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
KDM4C Q9H3R0 1/20 0.39

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
SCHEMBL27398109 0.81 KDM4E (0.47) LMNAMEN1KMT2APABPC1DAO
SCHEMBL2068622 0.80 LMNA (0.67) LMNAMEN1KMT2APABPC1PDE3B
SCHEMBL11160869 0.78 LMNA (0.59) LMNAMEN1KMT2APABPC1PDE3B
SCHEMBL30176645 0.78 MEN1 (0.55) LMNAMEN1KMT2APABPC1PDE3B
SCHEMBL16593900 0.76 MEN1 (0.61) LMNAMEN1KMT2APABPC1PDE3B
SCHEMBL25404651 0.75 LMNA (0.59) LMNAMEN1KMT2APABPC1PDE3B
SCHEMBL11158720 0.75 LMNA (0.59) LMNAMEN1KMT2APABPC1PDE3B
SCHEMBL30349583 0.75 LMNA (0.59) LMNAMEN1KMT2APABPC1PDE3B
SCHEMBL12942105 0.75 ALDH1A1 (0.44) LMNAMEN1KMT2APABPC1KDM4E
SCHEMBL16455985 0.73 JAK2 (0.49) LMNAMEN1KMT2APABPC1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110201629-A1 CYCLOHEXYL AMIDE DERIVATIVES AS CRF RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2011-08-18 US disclosed
US-20110201629-A1 CYCLOHEXYL AMIDE DERIVATIVES AS CRF RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2011-08-18 US disclosed
WO-2011092293-A2 CYCLOHEXYL AMIDE DERIVATIVES AS CRF RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2011-08-04 WO disclosed
WO-2011092293-A2 CYCLOHEXYL AMIDE DERIVATIVES AS CRF RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2011-08-04 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-20110201629-A1 CYCLOHEXYL AMIDE DERIVATIVES AS CRF RECEPTOR ANTAGONISTS CRHR1, CRHR2, CRH LMNA 4449/4885MEN1 2265/4885KMT2A 3173/4885

“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.