SCHEMBL884574

SCHEMBL884574

c1cncc(C(Cc2cccnc2Nc2ccc3ncccc3c2)c2cccnc2)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 10/20 0.46
GRM4 Q14833 1/20 0.45
KCNH2 Q12809 4/20 0.44
EGFR P00533 1/20 0.44
FAAH O00519 1/20 0.42
TGFBR1 P36897 1/20 0.41
SYK P43405 1/20 0.41
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
ULK1 O75385 1/20 0.40
ULK2 Q8IYT8 1/20 0.40
ABCB1 P08183 1/20 0.40
ABCC1 P33527 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
AURKA O14965 1/20 0.40
PABPC1 P11940 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
SCHEMBL884797 0.90 KCNA5 (0.46) KCNA5KCNH2MEN1NPC1MAPT
SCHEMBL884875 0.83 KCNA5 (0.56) KCNA5KCNH2
SCHEMBL884975 0.83 KCNA5 (0.52) KCNA5KCNH2
SCHEMBL884464 0.82 KCNA5 (0.56) KCNA5KCNH2
SCHEMBL2062733 0.81 KCNA5 (0.54) KCNA5KCNH2MEN1KMT2AAURKA
SCHEMBL885036 0.81 KCNA5 (0.48) KCNA5GRM4KCNH2MAPT
SCHEMBL885048 0.80 KCNA5 (0.56) KCNA5KCNH2EGFRABCG2
SCHEMBL2062719 0.79 KCNA5 (0.43) KCNA5KCNH2SYK
SCHEMBL884707 0.79 TUBB4A (0.50) KCNA5KCNH2NPC1MAPT
SCHEMBL884842 0.78 CYP19A1 (0.48) KCNA5KCNH2SYKNPC1POLB

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
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

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 11/4885GRM4 2449/4885KCNH2 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.