SCHEMBL2851367

SCHEMBL2851367

CO[C@H]1CN(C(=O)O)CC[C@H]1N(Cc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.44
CHRM1 P11229 2/20 0.44
CHRM3 P20309 2/20 0.44
SIGMAR1 Q99720 1/20 0.44
CHRM2 P08172 1/20 0.44
HTR2A P28223 6/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
CYP2C19 P33261 1/20 0.41
CCR5 P51681 6/20 0.41
HTT P42858 1/20 0.41
PDE4B Q07343 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
SCHEMBL2851369 1.00 CHRM5 (0.44) CHRM5CHRM1CHRM3SIGMAR1CHRM2
SCHEMBL2850359 0.88 JAK2 (0.52) SMN1; SMN2NPC1RAB9AHTT
SCHEMBL2850358 0.88 JAK2 (0.52) SMN1; SMN2NPC1RAB9AHTT
SCHEMBL16390979 0.88 CHRM5 (0.41) CHRM5CHRM1CHRM3SIGMAR1CHRM2
SCHEMBL15251347 0.88 CHRM5 (0.41) CHRM5CHRM1CHRM3SIGMAR1CHRM2
SCHEMBL2845920 0.86 HTR2A (0.40) CHRM5CHRM1CHRM3SIGMAR1CHRM2
SCHEMBL15251348 0.86 HTR2A (0.45) CHRM5CHRM1CHRM3SIGMAR1CHRM2
SCHEMBL2845923 0.86 HTR2A (0.40) CHRM5CHRM1CHRM3SIGMAR1CHRM2
SCHEMBL2844268 0.85 HTR2A (0.42) CHRM5CHRM1CHRM3SIGMAR1CHRM2
SCHEMBL2844266 0.85 HTR2A (0.42) CHRM5CHRM1CHRM3SIGMAR1CHRM2

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 6 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-8927588-B2 Imidazole carbonyl compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-01-06 US disclosed
US-20140073622-A1 IMIDAZOLE CARBONYL COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2014-03-13 US 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 (2 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 CHRM5 4718/4885CHRM1 4513/4885CHRM3 4533/4885
US-20140073622-A1 IMIDAZOLE CARBONYL COMPOUND TOP1, TOP2B, TOP2A CHRM5 4744/4885CHRM1 3863/4885CHRM3 4615/4885

“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.