SCHEMBL2062845

SCHEMBL2062845

COc1ccccc1-c1cc(F)ccc1CC(c1cccnc1)c1cccnc1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 14/20 0.57
KCNH2 Q12809 7/20 0.57
PDE4D Q08499 2/20 0.42
POLB P06746 1/20 0.40
PDE4A P27815 1/20 0.40
CTSA P10619 2/20 0.40

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
SCHEMBL2062370 0.86 KCNA5 (0.61) KCNA5KCNH2CTSA
SCHEMBL2063808 0.85 KCNA5 (0.61) KCNA5KCNH2
SCHEMBL2063464 0.85 KCNA5 (0.62) KCNA5KCNH2PDE4DPDE4ACTSA
SCHEMBL2063865 0.84 KCNA5 (0.61) KCNA5KCNH2PDE4DCTSA
SCHEMBL884817 0.82 PDE4A (0.46) KCNA5KCNH2PDE4DPDE4A
SCHEMBL2062680 0.82 KCNA5 (0.60) KCNA5KCNH2
SCHEMBL884335 0.81 KCNA5 (0.53) KCNA5KCNH2PDE4D
SCHEMBL2062960 0.81 KCNA5 (0.60) KCNA5KCNH2CTSA
SCHEMBL2064429 0.81 KCNA5 (0.69) KCNA5KCNH2
SCHEMBL884604 0.81 KCNA5 (0.60) 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 3 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
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 11/4885KCNH2 3/4885PDE4D 2352/4885

“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.