SCHEMBL4691244

SCHEMBL4691244

O=C([C@@H](O)C1CC1)N1CC(c2cc(F)ccc2F)=C[C@H]1c1cccc(OP(=O)(O)O)c1

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 19/20 0.73
KCNH2 Q12809 15/20 0.73

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
SCHEMBL14277510 1.00 KIF11 (0.73) KIF11KCNH2
SCHEMBL14302059 1.00 KIF11 (0.73) KIF11KCNH2
SCHEMBL4689954 0.87 KIF11 (0.73) KIF11KCNH2
SCHEMBL4060252 0.85 KIF11 (1.00) KIF11KCNH2
SCHEMBL4059774 0.85 KIF11 (1.00) KIF11KCNH2
SCHEMBL4788684 0.85 KIF11 (0.56) KIF11KCNH2
SCHEMBL4059946 0.84 KIF11 (1.00) KIF11KCNH2
SCHEMBL4689759 0.83 KIF11 (0.72) KIF11KCNH2
SCHEMBL4059323 0.81 KIF11 (0.90) KIF11KCNH2
SCHEMBL5104270 0.79 KIF11 (0.71) KIF11KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1636182-A4 PRODRUGS OF MITOTIC KINESIN INHIBITORS MERCK & CO INC (US) 2008-09-03 EP claimed
EP-1636182-A2 PRODRUGS OF MITOTIC KINESIN INHIBITORS Merck & Co., Inc. (US) 2006-03-22 EP claimed
WO-2004111193-A2 PRODRUGS OF MITOTIC KINESIN INHIBITORS MERCK & CO., INC. (US) 2004-12-23 WO claimed
EP-1636182-A4 PRODRUGS OF MITOTIC KINESIN INHIBITORS MERCK & CO INC (US) 2008-09-03 EP disclosed
US-7329762-B2 Prodrugs of mitotic kinesin inhibitors MERCK & CO., INC. (US) 2008-02-12 US disclosed
US-20060135594-A1 Prodrugs of mitotic kinesin inhibitors MERCK SHARP & DOHME CORP. 2006-06-22 US disclosed
EP-1636182-A2 PRODRUGS OF MITOTIC KINESIN INHIBITORS Merck & Co., Inc. (US) 2006-03-22 EP disclosed
WO-2004111193-A2 PRODRUGS OF MITOTIC KINESIN INHIBITORS MERCK & CO., INC. (US) 2004-12-23 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-20060135594-A1 Prodrugs of mitotic kinesin inhibitors KIF2C, KIF5B, KIFC1 KIF11 11/4885KCNH2 2099/4885

“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.