SCHEMBL5653700

SCHEMBL5653700

CCc1nn(CCO[Si](C)(C)C(C)(C)C)c(Oc2ccccn2)c1Oc1cc(C#N)cc(C#N)c1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.37
LTA4H P09960 1/20 0.31
PTGS2 P35354 1/20 0.31
GRM5 P41594 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
SCHEMBL5651795 0.86 KCNH2 (0.40) KCNH2LTA4HPTGS2GRM5
SCHEMBL5647263 0.82 KCNH2 (0.44) KCNH2LTA4HPTGS2GRM5
SCHEMBL508891 0.75 KCNH2 (0.38) KCNH2
SCHEMBL509726 0.68 KCNH2 (0.34) KCNH2
SCHEMBL5754002 0.66
SCHEMBL508952 0.66 KCNH2 (0.41) KCNH2
SCHEMBL5224343 0.66 KCNH2 (0.49) KCNH2
SCHEMBL14599402 0.66 KCNH2 (0.49) KCNH2
SCHEMBL508721 0.66 KCNH2 (0.30) KCNH2
SCHEMBL14540425 0.64 KCNH2 (0.50) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7230025-B2 Pyrazole derivatives PFIZER, INC. (US) 2007-06-12 US disclosed
US-7230025-B2 Pyrazole derivatives PFIZER, INC. (US) 2007-06-12 US disclosed
US-20040110816-A1 Pyrazole derivatives PFIZER, INC. 2004-06-10 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-20040110816-A1 Pyrazole derivatives REV1, POLR2E, SARS1 KCNH2 2890/4885LTA4H 1357/4885PTGS2 3611/4885

“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.