SCHEMBL5436745

SCHEMBL5436745

CC(C)(C)OC(=O)N[C@@H]1CCCN(c2nc3cc(C(=O)O)[nH]c(=O)c3n2Cc2cc(F)ccc2Cl)C1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 14/20 0.53
FAP Q12884 2/20 0.45
KDM4D Q6B0I6 1/20 0.41
F10 P00742 1/20 0.40
JAK3 P52333 1/20 0.40
BTK Q06187 1/20 0.40
MAP4K4 O95819 2/20 0.40
DDR1 Q08345 1/20 0.38

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
SCHEMBL5431270 0.94 DPP4 (0.52) DPP4FAPKDM4DF10JAK3
SCHEMBL5430371 0.91 ALDH1A1 (0.48) DPP4
SCHEMBL5444485 0.85 ALDH1A1 (0.47) DPP4JAK3BTKMAP4K4
SCHEMBL14505086 0.85 ALDH1A1 (0.47) DPP4BTKMAP4K4
SCHEMBL14504943 0.84 DPP4 (0.56) DPP4FAPMAP4K4
SCHEMBL14505095 0.84 ALDH1A1 (0.46) DPP4JAK3BTK
SCHEMBL5439519 0.83 ALDH1A1 (0.46) DPP4JAK3BTK
SCHEMBL14505195 0.83 DPP4 (0.53) DPP4FAPKDM4DF10JAK3
SCHEMBL5431587 0.83 DPP4 (0.45) DPP4
SCHEMBL5436663 0.82 ALDH1A1 (0.45) DPP4JAK3BTK

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-20070105890-A1 Novel condensed imidazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD 2007-05-10 US disclosed
US-20070105890-A1 Novel condensed imidazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD 2007-05-10 US disclosed
EP-1690863-A1 NOVEL CONDENSED IMIDAZOLE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-08-16 EP 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-20070105890-A1 Novel condensed imidazole derivative DPP4, DPP7, DPP3 DPP4 1/4885FAP 346/4885KDM4D 302/4885

“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.