SCHEMBL5233236

SCHEMBL5233236

CC(C)Cn1c(N(C)C(=O)O)c(-c2ccc(Cl)cc2)c2cc(O)ccc2c1=O

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.53
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 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
SCHEMBL5239911 0.91 DPP4 (0.54) DPP4
SCHEMBL5237906 0.91 DPP4 (0.65) DPP4
SCHEMBL5233697 0.90 DPP4 (0.53) DPP4ESR1
SCHEMBL27599276 0.87 DPP4 (0.46) DPP4CNR1CNR2
SCHEMBL5234480 0.86 DPP4 (0.59) DPP4
SCHEMBL6704523 0.84 DPP4 (0.49) DPP4
SCHEMBL5234601 0.83 DPP4 (0.60) DPP4
SCHEMBL5235167 0.83 DPP4 (0.53) DPP4
SCHEMBL5238638 0.82 DPP4 (0.42) DPP4
SCHEMBL5236421 0.80 DPP4 (0.52) DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1355886-B1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL (JP) 2007-07-11 EP disclosed
US-20040082607-A1 Fused heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-29 US 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-20040082607-A1 Fused heterocyclic compounds DPP7, DPP4, METAP1 DPP4 2/4885ESR1 2222/4885ESR2 1489/4885

“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.