SCHEMBL1959935

SCHEMBL1959935

Fc1cc(F)c(Cn2ccc3nc(-c4c(F)cccc4F)nc-3c2)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.39
KDM5B Q9UGL1 1/20 0.32
CYP19A1 P11511 1/20 0.31
HRH4 Q9H3N8 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
SCHEMBL1958831 0.92 KCNH2 (0.40) KCNH2KDM5BHRH4
SCHEMBL1960353 0.84 KDM4E (0.38) KCNH2KDM5BCYP19A1
SCHEMBL1963287 0.82 RAB9A (0.42) KCNH2KDM5BCYP19A1
SCHEMBL1961657 0.81 KCNH2 (0.41) KCNH2KDM5BCYP19A1HRH4
SCHEMBL1958046 0.78 KCNH2 (0.41) KCNH2KDM5B
SCHEMBL1960665 0.77 SMN1; SMN2 (0.44) KCNH2
SCHEMBL1961659 0.73 LTA4H (0.36) KCNH2KDM5BHRH4
SCHEMBL1961171 0.73 KDM4E (0.37) KCNH2KDM5BCYP19A1
SCHEMBL13137747 0.72 KDM5B (0.42) KDM5BHRH4
SCHEMBL16628721 0.71 KCNH2 (0.42) KCNH2KDM5BCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2332938-B1 Viral inhibitors LEUVEN K U RES & DEV (BE) 2014-10-01 EP disclosed
US-8779141-B2 Viral inhibitors GILEAD SCIENCES, INC. (US) 2014-07-15 US disclosed
EP-1521754-B1 VIRAL INHIBITORS LEUVEN K U RES & DEV (BE) 2011-08-31 EP disclosed
EP-2332938-A1 Viral inhibitors K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) 2011-06-15 EP disclosed
US-7737162-B2 Viral inhibitors GILEAD SCIENCES, INC. (US) 2010-06-15 US disclosed
US-20100004281-A1 VIRAL INHIBITORS GILEAD SCIENCES, INC. 2010-01-07 US disclosed
US-20050239821-A1 Viral inhibitors KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2005-10-27 US disclosed
EP-1521754-A2 VIRAL INHIBITORS K.U.Leuven Research & Development (BE) 2005-04-13 EP disclosed
WO-2004005286-A2 VIRAL INHIBITORS K.U.LEUVEN RESEARCH & DEVELOPMENT (BE) 2004-01-15 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 (2 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-20100004281-A1 VIRAL INHIBITORS ZC3HAV1, MAVS, HAVCR2 KCNH2 2470/4885KDM5B 590/4885CYP19A1 3722/4885
US-20050239821-A1 Viral inhibitors ZC3HAV1, ZC3HAV1L, ACE KCNH2 2142/4885KDM5B 963/4885CYP19A1 2311/4885

“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.