SCHEMBL1709348

SCHEMBL1709348

CCC(CCCCN)C(=O)C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 7/20 0.46
CA2 P00918 6/20 0.44
CA1 P00915 4/20 0.44
GSR P00390 1/20 0.41
MAPK1 P28482 1/20 0.41
RNPEP Q9H4A4 1/20 0.39
GNAI3 P08754 1/20 0.37
GNAO1 P09471 1/20 0.37
GNAI1 P63096 1/20 0.37

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
SCHEMBL19483410 0.84 CPB2 (0.44) CPB2CA2CA1GSRRNPEP
SCHEMBL19483409 0.84 CPB2 (0.44) CPB2CA2CA1GSRRNPEP
SCHEMBL18543797 0.83 CA2 (0.54) CA2CA1MAPK1
SCHEMBL19483416 0.82 CPB2 (0.47) CPB2GSRRNPEPGNAI3GNAO1
SCHEMBL19483403 0.82 CPB2 (0.47) CPB2GSRRNPEPGNAI3GNAO1
SCHEMBL10001196 0.81 CA2 (0.61) CA2CA1MAPK1
SCHEMBL1705447 0.80 GSR (0.41) CPB2CA2CA1GSRRNPEP
SCHEMBL19710550 0.79 CA2 (0.69) CPB2CA2CA1GSRMAPK1
SCHEMBL12298621 0.79 CPB2 (0.49) CPB2CA2CA1GSRMAPK1
SCHEMBL7559158 0.79 CA2 (0.69) CPB2CA2CA1GSRMAPK1

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-10017522-B2 Alpha helix mimetics and methods relating thereto Prism BioLab Co., Ltd. (JP) 2018-07-10 US disclosed
US-20120088770-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BIOLAB CORPORATION (JP) 2012-04-12 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 (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-20120088770-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PLOD3, COL1A1, THPO CPB2 1640/4885CA2 4015/4885CA1 3499/4885
US-10017522-B2 Alpha helix mimetics and methods relating thereto PLOD3, COL1A1, THPO CPB2 1640/4885CA2 4015/4885CA1 3499/4885

“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.