SCHEMBL13066471

SCHEMBL13066471

CN/C(=N\C#N)NC1CC(CNC(=O)c2ccccc2OC)(c2cccc(F)c2)C1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 18/20 0.47
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
KMT2A Q03164 1/20 0.46
P2RX7 Q99572 1/20 0.43

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
SCHEMBL13067026 0.93 KCNA3 (0.47) KCNA3MEN1ALDH1A1KMT2AP2RX7
SCHEMBL14491604 0.92 KCNA3 (0.59) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL14491605 0.92 KCNA3 (0.59) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL14491855 0.90 KCNA3 (0.53) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL14491854 0.90 KCNA3 (0.47) KCNA3MEN1ALDH1A1KMT2AP2RX7
SCHEMBL13067141 0.89 KCNA3 (0.48) KCNA3MEN1ALDH1A1KMT2AP2RX7
SCHEMBL14491606 0.85 KCNA3 (0.58) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL14491607 0.85 KCNA3 (0.58) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL18612716 0.85 KCNA3 (0.50) KCNA3MEN1ALDH1A1KMT2AP2RX7
SCHEMBL14491611 0.84 KCNA3 (0.56) KCNA3MEN1ALDH1A1KMT2A

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
EP-2253328-A1 Cycloalkyl inhibitors of potassium channel function Bristol-Myers Squibb Company (US) 2010-11-24 EP disclosed
US-20070142333-A1 CYCLOALKYL INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2007-06-21 US disclosed
US-20070142333-A1 CYCLOALKYL INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2007-06-21 US disclosed
US-7202253-B2 Cycloalkyl inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-10 US disclosed
US-7202253-B2 Cycloalkyl inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-10 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-20070142333-A1 CYCLOALKYL INHIBITORS OF POTASSIUM CHANNEL FUNCTION KCNJ2, KCNN3, KCNQ5 KCNA3 18/4885MEN1 4430/4885ALDH1A1 4075/4885

“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.