SCHEMBL15480932

SCHEMBL15480932

C#CCC(CC(=O)O)OP

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.33
GRIK2 Q13002 2/20 0.33
SLC22A6 Q4U2R8 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
TSHR P16473 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
SCHEMBL7817581 0.76 GRIK1 (0.32) GRIK1GRIK2SLC22A6SMN1; SMN2LMNA
SCHEMBL28006914 0.70 SLC22A6 (0.39) GRIK1GRIK2SLC22A6SMN1; SMN2LMNA
SCHEMBL4747479 0.69
SCHEMBL4747485 0.69
SCHEMBL2036772 0.67
SCHEMBL9861624 0.67
SCHEMBL9861172 0.67
SCHEMBL40318 0.67
SCHEMBL2031132 0.67
SCHEMBL3104554 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8853418-B2 Cyclopentylpyrazoles as N-type calcium channel blockers JANSSEN PHARMACEUTICA NV (BE) 2014-10-07 US disclosed
US-8853418-B2 Cyclopentylpyrazoles as N-type calcium channel blockers JANSSEN PHARMACEUTICA NV (BE) 2014-10-07 US disclosed
US-20140051660-A1 CYCLOPENTYLPYRAZOLES AS N-TYPE CALCIUM CHANNEL BLOCKERS JANSSEN PHARMACEUTICA NV (BE) 2014-02-20 US disclosed
US-20140051660-A1 CYCLOPENTYLPYRAZOLES AS N-TYPE CALCIUM CHANNEL BLOCKERS JANSSEN PHARMACEUTICA NV (BE) 2014-02-20 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-20140051660-A1 CYCLOPENTYLPYRAZOLES AS N-TYPE CALCIUM CHANNEL BLOCKERS CACNA1A, CACNA1B, CACNA1E GRIK1 312/4885GRIK2 455/4885SLC22A6 2314/4885

“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.