SCHEMBL694135

SCHEMBL694135

O=C(NOCC1CC1)c1c(Nc2ccc(Br)cc2F)c(F)c(=O)n2c1CCC2

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 19/20 0.63
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL693000 0.92 MAP2K1 (0.56) MAP2K1MEN1KMT2ATDP1
SCHEMBL716680 0.92 MAP2K1 (0.65) MAP2K1MEN1KMT2ATDP1
SCHEMBL696733 0.92 MAP2K1 (0.64) MAP2K1
SCHEMBL697484 0.90 MAP2K1 (0.79) MAP2K1MEN1KMT2ATDP1
SCHEMBL13148457 0.90 MAP2K1 (0.63) MAP2K1MEN1KMT2ATDP1
SCHEMBL696740 0.89 MAP2K1 (0.66) MAP2K1
SCHEMBL696784 0.88 MAP2K1 (0.62) MAP2K1MEN1KMT2ATDP1
SCHEMBL695855 0.88 MAP2K1 (0.81) MAP2K1
SCHEMBL696874 0.88 MAP2K1 (0.61) MAP2K1MEN1KMT2ATDP1
SCHEMBL696056 0.87 MAP2K1 (0.63) MAP2K1

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 disclosed
WO-2010121646-A1 HETEROCYCLIC COMPOUNDS AS MEK INHIBITORS NOVARTIS AG (CH) 2010-10-28 WO 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
US-20090275606-A1 Heterocyclic Compounds as MEK Inhibitors NOVARTIS AG 2009-11-05 US 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 48/4885MEN1 872/4885KMT2A 1364/4885

“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.