SCHEMBL5185284

SCHEMBL5185284

COc1ccc2ncc(F)c(C(=O)CCC3CCN(CCSc4cc(F)ccc4F)CC3C(=O)O)c2c1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 10/20 0.58

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
SCHEMBL5185295 1.00 KCNH2 (0.58) KCNH2
SCHEMBL5186326 1.00 KCNH2 (0.58) KCNH2
SCHEMBL6180731 1.00 KCNH2 (0.58) KCNH2
SCHEMBL6143168 0.94 KCNH2 (0.55) KCNH2
SCHEMBL6143163 0.94 KCNH2 (0.55) KCNH2
SCHEMBL5187064 0.92 KCNH2 (0.57) KCNH2
SCHEMBL5187060 0.92 KCNH2 (0.57) KCNH2
SCHEMBL6180558 0.92 KCNH2 (0.48) KCNH2
SCHEMBL5185457 0.92 KCNH2 (0.48) KCNH2
SCHEMBL5187054 0.90 KCNH2 (0.59) KCNH2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7232834-B2 Quinolylpropylpiperidine derivatives, intermediates and compositions containing them, and preparation therefor NOVEXEL SA (FR) 2007-06-19 US claimed
EP-1542988-B1 PIPERIDINE QUINOLYL PROPYL DERIVATIVES, PREPARATION METHOD AND INTERMEDIATES AND COMPOSITIONS CONTAINING SAME NOVEXEL (FR) 2006-04-12 EP claimed
US-20040087619-A1 Quinolylpropylpiperidine derivatives, intermediates and compositions containing them, and preparation therefor NOVEXEL SA (FR) 2004-05-06 US claimed
US-7232834-B2 Quinolylpropylpiperidine derivatives, intermediates and compositions containing them, and preparation therefor NOVEXEL SA (FR) 2007-06-19 US disclosed
EP-1542988-A1 PIPERIDINE QUINOLYL PROPYL DERIVATIVES, PREPARATION METHOD AND INTERMEDIATES AND COMPOSITIONS CONTAINING SAME Aventis Pharma S.A. (FR) 2005-06-22 EP disclosed
US-20040087619-A1 Quinolylpropylpiperidine derivatives, intermediates and compositions containing them, and preparation therefor NOVEXEL SA (FR) 2004-05-06 US disclosed
WO-2004024712-A1 PIPERIDINE QUINOLYL PROPYL DERIVATIVES, PREPARATION METHOD AND INTERMEDIATES AND COMPOSITIONS CONTAINING SAME AVENTIS PHARMA S.A. (FR) 2004-03-25 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-20040087619-A1 Quinolylpropylpiperidine derivatives, intermediates and compositions containing them, and preparation therefor FARSB, MRPL21, QTRT1 KCNH2 326/4885

“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.