SCHEMBL736904

SCHEMBL736904

Cn1ccc(N2CC3(CCN(c4ccc(OC5CCN(C6CCC6)CC5)nc4)CC3)OCC2=O)n1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 18/20 0.44
KCNH2 Q12809 1/20 0.39
ACACB O00763 1/20 0.35
HRH1 P35367 1/20 0.34
LCAT P04180 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
SCHEMBL738434 0.89 HRH3 (0.45) HRH3KCNH2ACACBLCAT
SCHEMBL736993 0.89 HRH3 (0.42) HRH3KCNH2HRH1
SCHEMBL736063 0.88 HRH3 (0.43) HRH3KCNH2ACACBHRH1
SCHEMBL735806 0.87 HRH3 (0.41) HRH3KCNH2ACACBHRH1
SCHEMBL736163 0.86 HRH3 (0.43) HRH3KCNH2ACACBHRH1
SCHEMBL737285 0.86 HRH3 (0.43) HRH3KCNH2ACACBHRH1
SCHEMBL735563 0.85 HRH3 (0.42) HRH3KCNH2ACACBHRH1
SCHEMBL735317 0.85 HRH3 (0.42) HRH3KCNH2ACACBHRH1
SCHEMBL737439 0.85 HRH3 (0.43) HRH3KCNH2HRH1
SCHEMBL738085 0.84 HRH3 (0.43) HRH3KCNH2ACACBHRH1LCAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090137576-A1 Novel Piperidine Derivative MSD K.K. (JP) 2009-05-28 US claimed
EP-1892241-A1 NOVEL PIPERIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-02-27 EP claimed
US-8138206-B2 Piperidine derivative MSD. K.K. (JP) 2012-03-20 US disclosed
US-20090137576-A1 Novel Piperidine Derivative MSD K.K. (JP) 2009-05-28 US disclosed
EP-1892241-A1 NOVEL PIPERIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-02-27 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-20090137576-A1 Novel Piperidine Derivative HRH4, HRH3, HRH1 HRH3 2/4885KCNH2 308/4885ACACB 4580/4885

“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.