SCHEMBL2848338

SCHEMBL2848338

COC(=O)c1sc(N2CC[C@@H](NC(=O)OCc3ccccc3)[C@@H](OC)C2)cc1C(C)=O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CPB1 P15086 2/20 0.41
CTSL P07711 1/20 0.39
CTSB P07858 1/20 0.39
CTSK P43235 1/20 0.39
OPRK1 P41145 2/20 0.38
TACR1 P25103 2/20 0.38
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
DPP4 P27487 3/20 0.36
KCNH2 Q12809 3/20 0.36
DPP7 Q9UHL4 3/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
ACHE P22303 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
GPR55 Q9Y2T6 1/20 0.36

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
SCHEMBL2848337 1.00 CPB1 (0.41) CPB1CTSLCTSBCTSKOPRK1
SCHEMBL2846253 0.90 CPB1 (0.42) CPB1CTSLCTSBCTSKOPRK1
SCHEMBL2846255 0.90 CPB1 (0.42) CPB1CTSLCTSBCTSKOPRK1
SCHEMBL2850161 0.88 CPB1 (0.42) CPB1CTSLCTSBCTSKOPRK1
SCHEMBL2850159 0.88 CPB1 (0.42) CPB1CTSLCTSBCTSKOPRK1
SCHEMBL2851621 0.87 CPB1 (0.40) CPB1CTSLCTSBCTSKOPRK1
SCHEMBL2851619 0.87 CPB1 (0.40) CPB1CTSLCTSBCTSKOPRK1
SCHEMBL2826391 0.87 CPB1 (0.40) CPB1CTSLCTSBCTSKOPRK1
SCHEMBL2826397 0.87 CPB1 (0.40) CPB1CTSLCTSBCTSKOPRK1
SCHEMBL2849029 0.83 CPB1 (0.44) CPB1CTSLCTSBCTSKALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2226322-B1 IMIDAZOLE CARBONYL COMPOUND DAIICHI SANKYO CO LTD (JP) 2015-01-21 EP disclosed
US-8536197-B2 Imidazole carbonyl compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-09-17 US disclosed
US-20100311966-A1 IMIDAZOLE CARBONYL COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-12-09 US disclosed
EP-2226322-A1 IMIDAZOLE CARBONYL COMPOUND Daiichi Sankyo Company, Limited (JP) 2010-09-08 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-20100311966-A1 IMIDAZOLE CARBONYL COMPOUND TOP1, TOP2B, TOP2A CPB1 1454/4885CTSL 1737/4885CTSB 683/4885

“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.