SCHEMBL7562243

SCHEMBL7562243

CCn1c(N2CCNCC2)nc2c1c(=O)[nH]c(=O)n2C.c1cc2cc-2c1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.69
POLB P06746 3/20 0.65
SIRT5 Q9NXA8 1/20 0.65
MEN1 O00255 5/20 0.61
KMT2A Q03164 5/20 0.61
MAPT P10636 3/20 0.61
MAPK1 P28482 2/20 0.61
TSHR P16473 6/20 0.55
GAA P10253 1/20 0.55
NPSR1 Q6W5P4 3/20 0.55
USP2 O75604 2/20 0.55
ALDH1A1 P00352 3/20 0.54
HTT P42858 2/20 0.54
HPGD P15428 1/20 0.54
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53

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
SCHEMBL5075295 0.90 DPP4 (0.71) DPP4POLBSIRT5MEN1KMT2A
SCHEMBL5075051 0.82 DPP4 (0.70) DPP4POLBSIRT5MEN1KMT2A
SCHEMBL555020 0.82 DPP4 (1.00) DPP4POLBSIRT5MEN1KMT2A
SCHEMBL5073403 0.82 DPP4 (0.79) DPP4POLBSIRT5MEN1KMT2A
SCHEMBL5075053 0.80 MEN1 (0.75) DPP4POLBSIRT5MEN1KMT2A
SCHEMBL7562242 0.80 DPP4 (0.84) DPP4POLBSIRT5MEN1KMT2A
SCHEMBL5075030 0.79 MEN1 (0.81) DPP4POLBSIRT5MEN1KMT2A
SCHEMBL5075029 0.79 POLB (0.84) DPP4POLBSIRT5MEN1KMT2A
SCHEMBL5639735 0.78 DPP4 (0.74) DPP4POLBSIRT5MEN1KMT2A
SCHEMBL22800900 0.78 DPP4 (0.74) DPP4POLBSIRT5MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020161001-A1 Heterocyclic compounds, which are inhibitors of the enzyme DPP-IV NOVO NORDISK A/S (DK) 2002-10-31 US claimed

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-20020161001-A1 Heterocyclic compounds, which are inhibitors of the enzyme DPP-IV DPP4, DPP7, DPP3 DPP4 1/4885POLB 3194/4885SIRT5 699/4885

“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.