SCHEMBL2846147

SCHEMBL2846147

CCc1[nH]c(C(=O)N[C@@H]2CCN(C(=S)n3ccnc3)C[C@@H]2OC)nc1Cl

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 7/20 0.39
KCNH2 Q12809 5/20 0.39
EHMT2 Q96KQ7 1/20 0.33

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
SCHEMBL2846143 1.00 HTR4 (0.39) HTR4KCNH2EHMT2
SCHEMBL2845748 0.93 ACKR3 (0.33) HTR4KCNH2
SCHEMBL2845743 0.93 ACKR3 (0.33) HTR4KCNH2
SCHEMBL2846492 0.84 HTR4 (0.40) HTR4KCNH2EHMT2
SCHEMBL2846488 0.84 HTR4 (0.40) HTR4KCNH2EHMT2
SCHEMBL2826840 0.83 ABCC2 (0.39) HTR4EHMT2
SCHEMBL2842898 0.83 ABCC2 (0.39) HTR4EHMT2
SCHEMBL2856364 0.79 PARP1 (0.42) HTR4KCNH2
SCHEMBL2856367 0.79 PARP1 (0.42) HTR4KCNH2
SCHEMBL2823581 0.78 JAK3 (0.36) HTR4

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 HTR4 1184/4885KCNH2 2740/4885EHMT2 2051/4885
US-20140073622-A1 IMIDAZOLE CARBONYL COMPOUND TOP1, TOP2B, TOP2A HTR4 1697/4885KCNH2 2469/4885EHMT2 2387/4885

“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.