SCHEMBL5437005

SCHEMBL5437005

CC(C)=CCn1c(N2CCC[C@@H](NC(=O)OC(C)(C)C)C2)nc2cc(C(=O)O)[nH]c(=O)c21

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 14/20 0.45
MAP4K4 O95819 2/20 0.41
JAK3 P52333 1/20 0.40
BTK Q06187 1/20 0.40
AURKA O14965 3/20 0.39
PDPK1 O15530 3/20 0.39
AURKB Q96GD4 3/20 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
SCHEMBL5437015 0.93 DPP4 (0.44) DPP4MAP4K4JAK3BTKAURKA
SCHEMBL556855 0.84 DPP4 (0.45) DPP4MAP4K4JAK3BTKAURKA
SCHEMBL5430371 0.84 ALDH1A1 (0.48) DPP4
SCHEMBL554976 0.82 MAPK1 (0.54) DPP4
SCHEMBL555316 0.82 MAPK1 (0.54) DPP4
SCHEMBL637617 0.82 MAPK1 (0.54) DPP4
SCHEMBL5436745 0.82 DPP4 (0.53) DPP4MAP4K4JAK3BTK
SCHEMBL762961 0.80 MAP4K4 (0.51) DPP4MAP4K4JAK3BTKAURKA
SCHEMBL555427 0.80 DPP4 (0.48) DPP4
SCHEMBL556010 0.80 DPP4 (0.44) 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 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 1/4885MAP4K4 708/4885JAK3 3576/4885

“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.