SCHEMBL884733

SCHEMBL884733

N#Cc1cccc(Nc2ncccc2CC(c2cccnc2)c2cccnc2)c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 11/20 0.53
KCNH2 Q12809 5/20 0.53
ABCG2 Q9UNQ0 5/20 0.48
SYK P43405 1/20 0.46
CSNK2A2 P19784 1/20 0.43
CSNK2B P67870 1/20 0.43
CSNK2A1 P68400 1/20 0.43
FLT1 P17948 1/20 0.42
FLT4 P35916 1/20 0.42
KDR P35968 1/20 0.42
SGMS2 Q8NHU3 1/20 0.41

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
SCHEMBL884842 0.88 CYP19A1 (0.48) KCNA5KCNH2ABCG2SYK
SCHEMBL2064504 0.87 CYP19A1 (0.48) KCNA5KCNH2ABCG2SGMS2
SCHEMBL884875 0.84 KCNA5 (0.56) KCNA5KCNH2
SCHEMBL884975 0.84 KCNA5 (0.52) KCNA5KCNH2KDR
SCHEMBL885048 0.80 KCNA5 (0.56) KCNA5KCNH2ABCG2
SCHEMBL884464 0.80 KCNA5 (0.56) KCNA5KCNH2
SCHEMBL884979 0.79 KCNA5 (0.48) KCNA5KCNH2
SCHEMBL884746 0.79 KCNA5 (0.69) KCNA5KCNH2
SCHEMBL884797 0.79 KCNA5 (0.46) KCNA5KCNH2ABCG2
SCHEMBL884574 0.78 KCNA5 (0.46) KCNA5KCNH2ABCG2SYK

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 7 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-20090233897-A1 Potassium Channel Inhibitors MERCK SHARP & DOHME CORP. 2009-09-17 US disclosed
EP-1940406-A2 POTASSIUM CHANNEL INHIBITORS Merck and Co., Inc. (US) 2008-07-09 EP 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 11/4885KCNH2 3/4885ABCG2 565/4885

“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.