SCHEMBL2359751

SCHEMBL2359751

CNCCCCOc1ccc(-n2nnnc2-c2cncc(Br)c2N)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 11/20 0.35
L3MBTL4 Q8NA19 1/20 0.32
L3MBTL3 Q96JM7 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL2357675 0.89 KCNN4 (0.35) KCNN4ALDH1A1
SCHEMBL2359330 0.84 KCNN4 (0.35) KCNN4L3MBTL4L3MBTL3TDP1
SCHEMBL2356773 0.83 KCNN4 (0.42) KCNN4ALDH1A1
SCHEMBL10100495 0.77 FYN (0.35) KCNN4ALDH1A1
SCHEMBL2356890 0.76 LRRK2 (0.40)
SCHEMBL10100496 0.76 ACHE (0.38) KCNN4ALDH1A1
SCHEMBL10100655 0.75 NEK2 (0.37) KCNN4L3MBTL4L3MBTL3ALDH1A1
Hydrochloric Acid SCHEMBL2358908 0.75 LRRK2 (0.39)
SCHEMBL10100510 0.74 FYN (0.40) KCNN4
SCHEMBL10100493 0.74 FYN (0.41) 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 4066/4885L3MBTL4 3227/4885L3MBTL3 2965/4885

“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.