SCHEMBL1267174

SCHEMBL1267174

COc1ccc2ncc3c(c2n1)C(CN1CCC(NC(C2=CC=CCC2)C2=COC=CO2)CC1)CO3

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 11/20 0.36
SLC2A1 P11166 1/20 0.32

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
SCHEMBL5254382 0.80 KCNH2 (0.51) KCNH2SLC2A1
SCHEMBL1267923 0.73 KCNH2 (0.46) KCNH2SLC2A1
SCHEMBL3687654 0.73 KCNH2 (0.37) KCNH2
SCHEMBL1076723 0.72 KCNH2 (0.41) KCNH2SLC2A1
SCHEMBL622101 0.72 KCNH2 (0.35) KCNH2SLC2A1
SCHEMBL2540548 0.72 KCNH2 (0.37) KCNH2SLC2A1
SCHEMBL2539639 0.72 KCNH2 (0.37) KCNH2SLC2A1
SCHEMBL5432611 0.72 KCNH2 (0.33) KCNH2
SCHEMBL5508377 0.71 KCNH2 (0.39) KCNH2
SCHEMBL5433395 0.71 KCNH2 (0.33) KCNH2SLC2A1

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-20110039836-A1 TRICYCLIC ANTIBIOTICS ACTELION PHARMACEUTICALS LTD. (CH) 2011-02-17 US claimed
US-8012961-B2 Tricyclic antibiotics ACTELION PHARMACEUTICAL LTD. (CH) 2011-09-06 US disclosed
US-20110039836-A1 TRICYCLIC ANTIBIOTICS ACTELION PHARMACEUTICALS LTD. (CH) 2011-02-17 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-20110039836-A1 TRICYCLIC ANTIBIOTICS OPRM1, UBE2D3, METTL3 KCNH2 924/4885SLC2A1 4373/4885

“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.