SCHEMBL4635341

SCHEMBL4635341

NC1C2CN(c3ccc(C(F)(F)F)cn3)CC12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
KDM4E B2RXH2 2/20 0.53
ABL1 P00519 1/20 0.53
CYP3A4 P08684 2/20 0.49
HSD11B1 P28845 1/20 0.47
HCRTR1 O43613 4/20 0.47
HCRTR2 O43614 4/20 0.47
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
ACACB O00763 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
MAPT P10636 3/20 0.45
GAA P10253 1/20 0.45
DPP4 P27487 2/20 0.45
DPP8 Q6V1X1 2/20 0.45
DPP9 Q86TI2 2/20 0.45
DPP7 Q9UHL4 2/20 0.45
HPGD P15428 1/20 0.44
GPR119 Q8TDV5 1/20 0.43

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
SCHEMBL4479608 0.87 KDM4E (0.56) LMNAKDM4EABL1CYP3A4HSD11B1
SCHEMBL67487 0.83 KDM4E (0.50) LMNAKDM4EABL1CYP3A4HSD11B1
SCHEMBL16497944 0.83 KDM4E (0.50) LMNAKDM4EABL1CYP3A4HSD11B1
SCHEMBL785166 0.79 KDM4E (0.61) LMNAKDM4EABL1CYP3A4CYP2C9
SCHEMBL1349588 0.79 KDM4E (0.61) LMNAKDM4EABL1CYP3A4CYP2C9
SCHEMBL3030259 0.79 KDM4E (0.61) LMNAKDM4EABL1CYP3A4CYP2C9
SCHEMBL1351273 0.78 KDM4E (0.68) LMNAKDM4EABL1CYP3A4HSD11B1
SCHEMBL25154535 0.78 KDM4E (0.53) LMNAKDM4EABL1CYP3A4HSD11B1
SCHEMBL2177287 0.78 KDM4E (0.50) LMNAKDM4EABL1CYP3A4HSD11B1
SCHEMBL31381191 0.78 KDM4E (0.76) LMNAKDM4EABL1HSD11B1HCRTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080300251-A1 Derivatives of 3-Azabicyclo[3.1.0] Hexane as Dipeptidyl Peptidase-IV Inhibitors RANBAXY LABORATORIES LIMITED (IN) 2008-12-04 US disclosed
EP-1931633-A2 DERIVATIVES OF 3-AZABICYCLO[3.1.0]HEXANE AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS Ranbaxy Laboratories Limited (IN) 2008-06-18 EP disclosed
WO-2007029086-A2 DERIVATIVES OF 3-AZABICYCLO[3.1.0]HEXANE AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2007-03-15 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-20080300251-A1 Derivatives of 3-Azabicyclo[3.1.0] Hexane as Dipeptidyl Peptidase-IV Inhibitors DPP4, DPP3, DPP8 LMNA 3634/4885KDM4E 227/4885ABL1 4740/4885

“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.