SCHEMBL884638

SCHEMBL884638

CS(=O)(=O)c1ccccc1Nc1ncccc1CC(c1cccnc1)c1cccnc1F

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 15/20 0.40
ALK Q9UM73 2/20 0.40
KCNH2 Q12809 4/20 0.38
ADRA1A P35348 1/20 0.35
KMT2A Q03164 1/20 0.34
JAK1 P23458 1/20 0.34
TYK2 P29597 1/20 0.34

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
SCHEMBL884789 0.90 KCNA5 (0.45) KCNA5ALKKCNH2ADRA1AJAK1
SCHEMBL884615 0.83 KCNA5 (0.41) KCNA5ALKKCNH2JAK1TYK2
SCHEMBL884637 0.82 KCNA5 (0.42) KCNA5KCNH2
SCHEMBL2062650 0.77 KCNA5 (0.48) KCNA5KCNH2
SCHEMBL885763 0.74 KCNA5 (0.45) KCNA5KCNH2
SCHEMBL1369059 0.74 ALK (0.45) ALKKCNH2ADRA1AKMT2AJAK1
SCHEMBL2062493 0.72 KCNA5 (0.50) KCNA5KCNH2
SCHEMBL885855 0.71 KCNA5 (0.43) KCNA5KCNH2
SCHEMBL884979 0.71 KCNA5 (0.48) KCNA5KCNH2JAK1TYK2
SCHEMBL884706 0.71 KCNA5 (0.51) KCNA5KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233897-A1 Potassium Channel Inhibitors MERCK SHARP & DOHME CORP. 2009-09-17 US claimed
EP-1940406-A2 POTASSIUM CHANNEL INHIBITORS Merck and Co., Inc. (US) 2008-07-09 EP claimed
WO-2007050348-A2 POTASSIUM CHANNEL INHIBITORS MERCK & CO., INC. (US) 2007-05-03 WO claimed
US-8148535-B2 Potassium channel inhibitors MERCK SHARP & DOHME CORP. (US) 2012-04-03 US disclosed
US-8148535-B2 Potassium channel inhibitors MERCK SHARP & DOHME CORP. (US) 2012-04-03 US disclosed
US-20090233897-A1 Potassium Channel Inhibitors MERCK SHARP & DOHME CORP. 2009-09-17 US disclosed
US-20090233897-A1 Potassium Channel Inhibitors MERCK SHARP & DOHME CORP. 2009-09-17 US disclosed
WO-2007050348-A2 POTASSIUM CHANNEL INHIBITORS MERCK & CO., INC. (US) 2007-05-03 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-20090233897-A1 Potassium Channel Inhibitors KCNJ2, KCNQ2, KCNH2 KCNA5 11/4885ALK 2138/4885KCNH2 3/4885

“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.