SCHEMBL6207841

SCHEMBL6207841

CSc1ccc(Nc2c(-c3nnc(NCCO)o3)ccc(F)c2F)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 8/20 0.36
MAP2K2 P36507 4/20 0.36
KDR P35968 2/20 0.35
CYP3A4 P08684 1/20 0.35
GSK3B P49841 1/20 0.33
PDCD1 Q15116 4/20 0.32
CD274 Q9NZQ7 4/20 0.32
CHRNA7 P36544 4/20 0.31
KCNH2 Q12809 4/20 0.31
RXFP1 Q9HBX9 1/20 0.31
FLT1 P17948 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
SCHEMBL6396688 0.87 MAP2K1 (0.35) MAP2K1MAP2K2GSK3B
SCHEMBL6208441 0.87 MAP2K1 (0.35) MAP2K1MAP2K2GSK3B
SCHEMBL6188842 0.86 GSK3B (0.33) MAP2K1MAP2K2GSK3B
SCHEMBL6205699 0.85 MAP2K1 (0.37) MAP2K1MAP2K2KDRCYP3A4PDCD1
SCHEMBL6208327 0.85 MAP2K1 (0.52) MAP2K1MAP2K2
SCHEMBL6399433 0.84 MAP2K1 (0.37) MAP2K1MAP2K2KDRCYP3A4PDCD1
SCHEMBL6191826 0.83 MAP2K1 (0.38) MAP2K1MAP2K2KDRCYP3A4
SCHEMBL6207193 0.82 MAP2K1 (0.35) MAP2K1MAP2K2KDRCYP3A4PDCD1
SCHEMBL6187354 0.80 MAP2K1 (0.48) MAP2K1MAP2K2
SCHEMBL6206623 0.79 PIM1 (0.36) MAP2K1MAP2K2KDRCYP3A4PDCD1

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-1578736-A1 MEK INHIBITING OXA- AND THIA-DIAZOL-2-YL-PHENYLAMINE DERIVATIVES Warner-Lambert Company LLC (US) 2005-09-28 EP claimed
US-20050004186-A1 MEK inhibiting compounds PFIZER INC 2005-01-06 US claimed
WO-2004056789-A1 MEK INHIBITING OXA- AND THIA-DIAZOL-2-YL PHENYLAMINE DERIVATES WARNER-LAMBERT COMPANY LLC (US) 2004-07-08 WO claimed
US-20050004186-A1 MEK inhibiting compounds PFIZER INC 2005-01-06 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-20050004186-A1 MEK inhibiting compounds MAPK1, MAP3K1, MAPK3 MAP2K1 46/4885MAP2K2 40/4885KDR 202/4885

“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.