SCHEMBL884297

SCHEMBL884297

O=C(NCCO)c1cccc(-c2ccccc2CC(c2cccnc2)c2cccnc2)c1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 10/20 0.67
KCNH2 Q12809 7/20 0.62
EPHX2 P34913 2/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
CDK4 P11802 1/20 0.46
CCND1 P24385 1/20 0.46
PTAFR P25105 1/20 0.46
FYN P06241 1/20 0.46
ADRB2 P07550 1/20 0.44
ADRB1 P08588 1/20 0.44
ADRB3 P13945 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
SUCNR1 Q9BXA5 2/20 0.44
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL884571 0.90 KCNA5 (0.64) KCNA5KCNH2EPHX2CYP2C9CYP2C19
SCHEMBL884480 0.89 KCNA5 (0.71) KCNA5KCNH2EPHX2CYP2C9CYP2C19
SCHEMBL885046 0.88 KCNA5 (0.67) KCNA5KCNH2EPHX2CYP2C9CYP2C19
SCHEMBL884585 0.87 KCNA5 (0.66) KCNA5KCNH2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL884680 0.87 KCNA5 (0.61) KCNA5KCNH2EPHX2CYP2C9CYP2C19
SCHEMBL884694 0.86 KCNA5 (0.65) KCNA5KCNH2EPHX2SMN1; SMN2KMT2A
SCHEMBL884716 0.86 KCNA5 (0.65) KCNA5KCNH2EPHX2CYP2C9CYP2C19
SCHEMBL884527 0.85 KCNA5 (0.66) KCNA5KCNH2ADRB2ADRB1ADRB3
SCHEMBL884739 0.85 KCNA5 (0.78) KCNA5KCNH2
SCHEMBL884689 0.85 KCNA5 (0.68) KCNA5KCNH2ADRB2ADRB1ADRB3

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 11/4885KCNH2 3/4885EPHX2 3824/4885

“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.