SCHEMBL1151053

SCHEMBL1151053

Cc1c(S(C)(=O)=O)n2c(=O)c(O)c(C(=O)NCc3ccc(F)cc3S(=O)(=O)N(C)C)nc2n1CC(=O)N1CC(C)CC(C)C1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.35
CYP2C9 P11712 1/20 0.32
KMT2A Q03164 2/20 0.32
GRIN2B Q13224 1/20 0.31
SLC22A2 O15244 2/20 0.31
CYP3A4 P08684 1/20 0.30
TMEM97 Q5BJF2 1/20 0.30
ABCG2 Q9UNQ0 1/20 0.30
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30

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
SCHEMBL1151050 0.84 KCNH2 (0.35) KCNH2CYP2C9KMT2AGRIN2BSLC22A2
SCHEMBL1150433 0.82 KCNH2 (0.34) KCNH2CYP2C9KMT2AGRIN2BSLC22A2
SCHEMBL1150531 0.80 CNR1 (0.39) CNR1CNR2
SCHEMBL12862259 0.79 CALCA (0.36) KCNH2CYP2C9KMT2A
SCHEMBL12862257 0.73 CALCA (0.36) KCNH2CYP2C9
SCHEMBL3842310 0.70 KCNH2 (0.48) KCNH2CYP2C9
SCHEMBL3836759 0.70 KCNH2 (0.48) KCNH2CYP2C9
SCHEMBL12862266 0.70 CALCA (0.40) KCNH2CYP2C9GRIN2B
SCHEMBL3842661 0.69 KCNH2 (0.46) KCNH2CYP2C9
SCHEMBL1151051 0.68 MEN1 (0.33) KMT2AGRIN2B

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
EP-2291377-B1 IMIDAZOPYRIMIDINONES AND USES THEREOF AVEXA LTD (AU) 2015-02-18 EP disclosed
US-8431581-B2 Imidazopyrimidines and uses thereof AVEXA LIMITED (AU) 2013-04-30 US disclosed
EP-2291377-A1 IMIDAZOPYRIMIDINONES AND USES THEREOF Avexa Limited (AU) 2011-03-09 EP disclosed
US-20110028487-A1 IMIDAZOPYRIMIDINES AND USES THEREOF AVEXA LIMITED (AU) 2011-02-03 US disclosed
WO-2010000031-A1 IMIDAZOPYRIMIDINONES AND USES THEREOF AVEXA LIMITED (AU) 2010-01-07 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-20110028487-A1 IMIDAZOPYRIMIDINES AND USES THEREOF TPMT, DPYD, IMPDH1 KCNH2 1681/4885CYP2C9 41/4885KMT2A 1900/4885

“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.