SCHEMBL4381194

SCHEMBL4381194

C1CCN(CCCNCCNCCCN2CCCCC2)CC1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.59
SCN5A Q14524 2/20 0.54
KDM1A O60341 1/20 0.46
CARM1 Q86X55 1/20 0.46
PRMT6 Q96LA8 1/20 0.46
PRMT8 Q9NR22 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 2/20 0.46
CYP1A2 P05177 1/20 0.45
MAPK1 P28482 1/20 0.45
ACE2 Q9BYF1 1/20 0.44
MAPT P10636 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 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
SCHEMBL17526224 0.97 HRH3 (0.55) HRH3SCN5AKDM1ACARM1PRMT6
SCHEMBL5911217 0.97 HRH3 (0.62) HRH3SCN5AKDM1ACARM1PRMT6
SCHEMBL5910693 0.95 HRH3 (0.57) HRH3SCN5AKDM1ACARM1PRMT6
SCHEMBL13661585 0.93 HRH3 (0.56) HRH3SCN5AKDM1ACARM1PRMT6
SCHEMBL17526233 0.92 HRH3 (0.55) HRH3SCN5AKDM1ACARM1PRMT6
SCHEMBL8307200 0.89 ACE2 (0.61) HRH3SCN5AKDM1ACARM1PRMT6
SCHEMBL29254420 0.87 HRH3 (0.62) HRH3SCN5AKDM1ACARM1PRMT6
SCHEMBL18024053 0.87 HRH3 (0.50) HRH3SCN5AKDM1ACARM1PRMT6
SCHEMBL22005759 0.87 HRH3 (0.50) HRH3SCN5AKDM1ACARM1PRMT6
SCHEMBL6510779 0.87 ACE2 (0.54) HRH3SCN5AKDM1ASMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090181948-A1 DIAMINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-07-16 US disclosed
EP-1847530-A1 DIAMINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-10-24 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-20090181948-A1 DIAMINE DERIVATIVE ARG1, PRMT5, PRMT1 HRH3 452/4885SCN5A 3513/4885KDM1A 449/4885

“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.