SCHEMBL785347

SCHEMBL785347

COc1cc(C(=O)N[C@@H]2CCc3ccc(C(=O)N(C)C4CCN(c5ccnc(C)c5)CC4)cc32)on1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 5/20 0.40
USP30 Q70CQ3 5/20 0.37
F10 P00742 3/20 0.37
CTSS P25774 1/20 0.37
F2 P00734 1/20 0.36
PLAT P00750 1/20 0.36
KLKB1 P03952 1/20 0.36
BDKRB1 P46663 3/20 0.36
ACACB O00763 1/20 0.36
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34

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
SCHEMBL785143 0.87 TSHR (0.45) WDR5USP30F10CTSSF2
SCHEMBL784917 0.86 WDR5 (0.39) WDR5USP30BDKRB1ACACBPDE4A
SCHEMBL784645 0.85 WDR5 (0.38) WDR5USP30BDKRB1PDE4APDE4B
SCHEMBL784620 0.82 WDR5 (0.42) WDR5F10CTSSF2PLAT
SCHEMBL784478 0.81 ALDH1A1 (0.41) WDR5F10CTSSF2PLAT
SCHEMBL784119 0.81 F10 (0.39) WDR5F10CTSSF2PLAT
SCHEMBL785422 0.81 F10 (0.40) WDR5USP30F10CTSSF2
SCHEMBL784804 0.80 F10 (0.41) WDR5F10CTSSF2PLAT
SCHEMBL784383 0.80 TAS1R3 (0.41) WDR5CTSSPDE4APDE4BPDE4C
SCHEMBL784800 0.80 WDR5 (0.40) WDR5F10CTSSF2PLAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US claimed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 US claimed
US-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US disclosed
US-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US disclosed
US-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US disclosed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 US disclosed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 US disclosed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 US 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-20120071461-A1 Substituted Benzamide Compounds BDKRB1, BDKRB2, HRH2 WDR5 2611/4885USP30 4164/4885F10 524/4885

“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.