SCHEMBL1430764

SCHEMBL1430764

CC(C)(C)C(NC(=O)O)C1CCN(CCN)CC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 2/20 0.41
GNAO1 P09471 2/20 0.41
GNAI1 P63096 2/20 0.41
POLB P06746 1/20 0.37
HTT P42858 1/20 0.37
CHRM3 P20309 1/20 0.36
PRCP P42785 4/20 0.33
CARM1 Q86X55 2/20 0.33
PRMT6 Q96LA8 2/20 0.33
ALOX15 P16050 1/20 0.33
PRMT3 O60678 1/20 0.33
PRMT1 Q99873 1/20 0.33
PRMT8 Q9NR22 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
DPP4 P27487 1/20 0.32
CHRM1 P11229 1/20 0.31

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
SCHEMBL1428056 0.79 CTSS (0.34) DPP4
SCHEMBL1428096 0.78 KDM1A (0.41) POLBHTTCARM1PRMT6ALOX15
SCHEMBL2276120 0.78 TP53 (0.34) POLBHTTPRCP
SCHEMBL1428067 0.77 EPHX1 (0.34) CARM1PRMT6ALOX15
SCHEMBL5312840 0.76 TACR2 (0.38)
SCHEMBL16336795 0.73 SMYD3 (0.31) DPP4
SCHEMBL1192553 0.73 SMYD3 (0.31) DPP4
SCHEMBL1743295 0.72 SHBG (0.35)
SCHEMBL482200 0.72 SHBG (0.35)
SCHEMBL1428152 0.71 GNAI3 (0.39) GNAI3GNAO1GNAI1POLBHTT

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-20130065926-A1 N-PIPERIDINYL ACETAMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS MARK G. DEGIACOMO, CHAPTER 7 TRUSTEE OF EPIRUS BIOPHARMACEUTICALS, INC. 2013-03-14 US disclosed
EP-2300007-A1 N-PIPERIDINYL ACETAMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS Zalicus Pharmaceuticals Ltd. (CA) 2011-03-30 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-20130065926-A1 N-PIPERIDINYL ACETAMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS CACNA1G, CACNA1H, CACNA1B GNAI3 1193/4885GNAO1 829/4885GNAI1 873/4885

“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.