SCHEMBL2357984

SCHEMBL2357984

COc1ccc(-n2nnnc2-c2cccnc2N)c(F)c1F

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 18/20 0.49
AKT1 P31749 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL1425283 0.86 KCNN4 (0.45) KCNN4
SCHEMBL2358883 0.83 KCNN4 (0.46) KCNN4ALDH1A1
SCHEMBL1426001 0.81 KCNN4 (0.42) KCNN4ALDH1A1
SCHEMBL985261 0.80 KCNN4 (0.55) KCNN4
SCHEMBL987916 0.78 KCNN4 (0.52) KCNN4ALDH1A1
SCHEMBL12810736 0.77 LRRK2 (0.45) KCNN4ALDH1A1
SCHEMBL12539009 0.76 FYN (0.35) KCNN4ALDH1A1
SCHEMBL2356773 0.76 KCNN4 (0.42) KCNN4ALDH1A1
SCHEMBL1425926 0.75 PDGFRB (0.39) KCNN4
SCHEMBL27918674 0.74 FYN (0.44) KCNN4ALDH1A1

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-8518938-B2 c-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-08-27 US disclosed
US-20120165333-A1 C-MET PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-06-28 US disclosed
EP-2350045-A1 C-MET PROTEIN KINASE INHIBITORS Vertex Pharmaceuticals Incorporated (US) 2011-08-03 EP disclosed
WO-2010048131-A1 C-MET PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-04-29 WO 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-20120165333-A1 C-MET PROTEIN KINASE INHIBITORS MET, PRKCH, ABL1 KCNN4 4066/4885AKT1 52/4885ALDH1A1 1951/4885

“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.