SCHEMBL26237635

SCHEMBL26237635

CCN(C)Cc1c(Cc2cccc(N)c2F)c(=O)oc2cc(OC(=O)N(C)C)c(F)cc12

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 20/20 0.59
RAF1 P04049 16/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2D6 P10635 1/20 0.59
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59
BRAF P15056 1/20 0.39

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
SCHEMBL29843095 0.87 MAP2K1 (0.76) MAP2K1RAF1CYP3A4CYP2D6CYP2C9
SCHEMBL960507 0.87 MAP2K1 (0.76) MAP2K1RAF1CYP3A4CYP2D6CYP2C9
SCHEMBL25144214 0.86 MAP2K1 (0.68) MAP2K1RAF1CYP3A4CYP2D6CYP2C9
SCHEMBL31190231 0.86 MAP2K1 (0.67) MAP2K1RAF1CYP3A4CYP2D6CYP2C9
SCHEMBL25394234 0.86 MAP2K1 (0.67) MAP2K1RAF1CYP3A4CYP2D6CYP2C9
SCHEMBL25144243 0.84 MAP2K1 (0.65) MAP2K1RAF1CYP3A4CYP2D6CYP2C9
SCHEMBL25392026 0.81 MAP2K1 (0.57) MAP2K1RAF1CYP3A4CYP2D6CYP2C9
SCHEMBL31190223 0.81 MAP2K1 (0.57) MAP2K1RAF1CYP3A4CYP2D6CYP2C9
SCHEMBL25143990 0.80 MAP2K1 (0.70) MAP2K1RAF1CYP3A4CYP2D6CYP2C9
SCHEMBL26237957 0.79 MAP2K1 (0.60) MAP2K1RAF1CYP3A4CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023133472-A1 MEK IMMUNE ONCOLOGY INHIBITORS AND THERAPEUTIC USES THEREOF IMMUNEERING CORPORATION (US) 2023-07-13 WO disclosed