SCHEMBL6668903

SCHEMBL6668903

Cc1c(N2CCC(CN)C2)c(F)c(C(F)F)c2c(=O)[nH]c(=O)n(C3CC3)c12

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 6/20 0.36
PIM1 P11309 1/20 0.31
CDK2 P24941 1/20 0.31
FLT4 P35916 1/20 0.31
CSNK2A1 P68400 1/20 0.31
PRKCD Q05655 1/20 0.31
PAK1 Q13153 1/20 0.31
MAPKAPK3 Q16644 1/20 0.31
PRKD2 Q9BZL6 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
TOP1 P11387 1/20 0.31
BPTF Q12830 1/20 0.30
TPH1 P17752 1/20 0.30
TPH2 Q8IWU9 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
SCHEMBL6670927 0.89 KCNH2 (0.36) KCNH2PIM1CDK2FLT4CSNK2A1
SCHEMBL6644884 0.87 KCNH2 (0.35) KCNH2PIM1CDK2FLT4CSNK2A1
SCHEMBL7096952 0.87 KCNH2 (0.33) KCNH2
SCHEMBL6644550 0.85 KCNH2 (0.34) KCNH2
SCHEMBL6667677 0.85 KCNH2 (0.43) KCNH2TOP1
SCHEMBL6669174 0.85 KCNH2 (0.34) KCNH2
SCHEMBL6669980 0.84 KCNH2 (0.34) KCNH2TPH1TPH2
SCHEMBL6669370 0.84 KCNH2 (0.40) KCNH2
SCHEMBL7096745 0.84 KCNH2 (0.35) KCNH2
SCHEMBL6668792 0.84 KCNH2 (0.41) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1401830-A2 QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS Warner-Lambert Company LLC (US) 2004-03-31 EP claimed
US-20030114666-A1 Having quinazolindione core structure; non-antibiotic resistance WARNER-LAMBERT COMPANY 2003-06-19 US claimed
WO-2002102793-A2 QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2002-12-27 WO claimed
US-20030114666-A1 Having quinazolindione core structure; non-antibiotic resistance WARNER-LAMBERT COMPANY 2003-06-19 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-20030114666-A1 Having quinazolindione core structure; non-antibiotic resistance ABCC1, RPS6KA1, SIGMAR1 KCNH2 143/4885PIM1 1570/4885CDK2 1766/4885

“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.