SCHEMBL5467100

SCHEMBL5467100

Cc1c(N2CCC(C3(NCCC#N)CC3)C2)ccc2c(=O)n(N)c(=O)n(C3CC3)c12

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 4/20 0.35
SCN5A Q14524 1/20 0.31
JAK2 O60674 1/20 0.30
JAK1 P23458 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
SCHEMBL5461918 0.94 KCNH2 (0.32) KCNH2JAK2JAK1
SCHEMBL5465766 0.90 CYP3A4 (0.37) KCNH2
SCHEMBL5460692 0.85 KCNH2 (0.49) KCNH2SCN5A
SCHEMBL5814993 0.84 KCNH2 (0.35) KCNH2SCN5A
SCHEMBL5464739 0.84 JAK2 (0.39) KCNH2JAK2JAK1
SCHEMBL5799322 0.84 JAK2 (0.34) KCNH2JAK2JAK1
SCHEMBL5454105 0.84 KCNH2 (0.34) KCNH2SCN5A
SCHEMBL5467095 0.83 KCNH2 (0.33) KCNH2JAK2JAK1
SCHEMBL5466750 0.82 KCNH2 (0.47) KCNH2SCN5AJAK2JAK1
SCHEMBL5464659 0.80 KCNH2 (0.44) KCNH2SCN5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070191333-A1 Antibacterial agents WARNER LAMBERT COMPANY LLC 2007-08-16 US claimed
US-20070191333-A1 Antibacterial agents WARNER LAMBERT COMPANY LLC 2007-08-16 US disclosed
US-20070191333-A1 Antibacterial agents WARNER LAMBERT COMPANY LLC 2007-08-16 US disclosed
EP-1687296-A1 ANTIBACTERIAL AMINOQUINAZOLIDINEDIONE DERIVATIVES Warner-Lambert Company LLC (US) 2006-08-09 EP disclosed
WO-2005049605-A1 ANTIBACTERIAL AMINOQUINAZOLIDINEDIONE DERIVATIVES WARNER-LAMBERT COMPANY LLC (US) 2005-06-02 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-20070191333-A1 Antibacterial agents MRPL21, RPN2, FBL KCNH2 2633/4885SCN5A 3616/4885JAK2 4764/4885

“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.