SCHEMBL4635199

SCHEMBL4635199

NC1C2CN(c3ncccc3Cl)CC12

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.46
PTPN11 Q06124 2/20 0.44
MALT1 Q9UDY8 3/20 0.43
TRPV1 Q8NER1 3/20 0.42
DPP4 P27487 1/20 0.42
TRPA1 O75762 1/20 0.40

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
SCHEMBL4778176 0.80 MALT1 (0.34) HSD11B1PTPN11MALT1TRPV1
SCHEMBL7396450 0.79 HSD11B1 (0.45) HSD11B1PTPN11MALT1TRPV1DPP4
SCHEMBL1350753 0.78 MALT1 (0.50) HSD11B1PTPN11MALT1TRPV1
Hydrochloric Acid SCHEMBL9005364 0.78 HSD11B1 (0.44) HSD11B1PTPN11MALT1TRPV1DPP4
SCHEMBL1350750 0.78 MALT1 (0.50) HSD11B1PTPN11MALT1TRPV1
SCHEMBL931726 0.77 MALT1 (0.56) HSD11B1MALT1TRPV1TRPA1
SCHEMBL4635503 0.76 KDM4E (0.54) HSD11B1DPP4
SCHEMBL4320157 0.76 EPHX2 (0.56) HSD11B1TRPV1DPP4
SCHEMBL4871696 0.75 CHRNB2 (0.50) HSD11B1PTPN11MALT1TRPV1
SCHEMBL20283136 0.75 HSD11B1 (0.48) HSD11B1MALT1TRPV1TRPA1

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 HSD11B1 251/4885PTPN11 2188/4885MALT1 1241/4885

“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.