SCHEMBL697790

SCHEMBL697790

O=c1cc(Nc2ccc(Br)cc2F)c(/C=N/O)c2n1CCC2

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 9/20 0.43
MAP2K2 P36507 1/20 0.43
EGFR P00533 3/20 0.36
MAPT P10636 3/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.35
KDR P35968 1/20 0.34

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
SCHEMBL697791 1.00 MAP2K1 (0.43) MAP2K1MAP2K2EGFRMAPTALDH1A1
SCHEMBL696727 0.88 MAP2K1 (0.43) MAP2K1MAP2K2EGFRMAPTALDH1A1
SCHEMBL697394 0.82 MAP2K1 (0.47) MAP2K1MAP2K2MAPTALDH1A1HSD17B10
SCHEMBL694244 0.80 MAP2K1 (0.53) MAP2K1MAP2K2ALDH1A1HSD17B10
SCHEMBL696253 0.79 MAP2K1 (0.55) MAP2K1MAP2K2ALDH1A1
SCHEMBL13148371 0.79 MAP2K1 (0.52) MAP2K1MAP2K2ALDH1A1
SCHEMBL696176 0.77 MAP2K1 (0.51) MAP2K1MAP2K2ALDH1A1
SCHEMBL698475 0.77 MAP2K1 (0.55) MAP2K1MAP2K2
SCHEMBL693420 0.77 MAP2K1 (0.50) MAP2K1MAP2K2ALDH1A1HSD17B10
SCHEMBL697078 0.77 MAP2K1 (0.40) MAP2K1MAP2K2MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2421612-A1 HETEROCYCLIC COMPOUNDS AS MEK INHIBITORS Novartis AG (CH) 2012-02-29 EP claimed
WO-2010121646-A1 HETEROCYCLIC COMPOUNDS AS MEK INHIBITORS NOVARTIS AG (CH) 2010-10-28 WO claimed
US-20090275606-A1 Heterocyclic Compounds as MEK Inhibitors NOVARTIS AG 2009-11-05 US claimed
EP-2421612-A1 HETEROCYCLIC COMPOUNDS AS MEK INHIBITORS Novartis AG (CH) 2012-02-29 EP disclosed
WO-2010121646-A1 HETEROCYCLIC COMPOUNDS AS MEK INHIBITORS NOVARTIS AG (CH) 2010-10-28 WO disclosed
US-20090275606-A1 Heterocyclic Compounds as MEK Inhibitors NOVARTIS AG 2009-11-05 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-20090275606-A1 Heterocyclic Compounds as MEK Inhibitors NRAS, BRAF, MAP3K1 MAP2K1 48/4885MAP2K2 38/4885EGFR 203/4885

“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.