SCHEMBL2852824

SCHEMBL2852824

CCc1[nH]c(C(=O)NC2CCN(c3ncccc3C(=O)O)CC2OC)nc1Cl

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.44
KMT2A Q03164 1/20 0.43
ABCC2 Q92887 1/20 0.42
RBP4 P02753 1/20 0.41
TTR P02766 1/20 0.41

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
SCHEMBL13787537 1.00 OPRK1 (0.44) OPRK1KMT2AABCC2RBP4TTR
SCHEMBL2852832 1.00 OPRK1 (0.44) OPRK1KMT2AABCC2RBP4TTR
SCHEMBL2844844 0.94 OPRK1 (0.51) OPRK1ABCC2
SCHEMBL2844848 0.94 OPRK1 (0.51) OPRK1ABCC2
SCHEMBL2850368 0.85 ABCC2 (0.40) ABCC2
SCHEMBL2850372 0.85 ABCC2 (0.40) ABCC2
SCHEMBL2848498 0.84 ABCC2 (0.43) ABCC2RBP4TTR
SCHEMBL2848502 0.84 ABCC2 (0.43) ABCC2RBP4TTR
SCHEMBL2853102 0.84 ABCC2 (0.41) ABCC2
SCHEMBL2853108 0.84 ABCC2 (0.41) ABCC2

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 OPRK1 3394/4885KMT2A 847/4885ABCC2 1441/4885
US-20140073622-A1 IMIDAZOLE CARBONYL COMPOUND TOP1, TOP2B, TOP2A OPRK1 3443/4885KMT2A 1335/4885ABCC2 849/4885

“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.