SCHEMBL31354762

SCHEMBL31354762

O=C(O)c1c(F)cc(F)c(F)c1Nc1ccc(I)cc1F

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 19/20 0.67
MAP2K2 P36507 8/20 0.67
IDO1 P14902 1/20 0.52
CA2 P00918 2/20 0.48

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
SCHEMBL5678316 0.88 MEN1 (0.56) MAP2K1MAP2K2IDO1CA2
SCHEMBL31354748 0.87 MAP2K1 (0.67) MAP2K1MAP2K2CA2
SCHEMBL31354741 0.87 MAP2K1 (0.58) MAP2K1MAP2K2CA2
SCHEMBL2953672 0.87 MAP2K1 (0.67) MAP2K1MAP2K2CA2
SCHEMBL24539656 0.87 MAP2K1 (0.64) MAP2K1MAP2K2IDO1
SCHEMBL29681825 0.87 MAP2K1 (0.64) MAP2K1MAP2K2IDO1
SCHEMBL1340491 0.83 MAP2K1 (0.57) MAP2K1MAP2K2IDO1CA2
SCHEMBL31354752 0.81 MAP2K1 (0.55) MAP2K1MAP2K2IDO1CA2
SCHEMBL28884401 0.80 MAP2K1 (0.88) MAP2K1MAP2K2IDO1
SCHEMBL30022894 0.80 MAP2K1 (0.88) MAP2K1MAP2K2IDO1

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-2025054260-A1 INHIBITORS OF MEK KINASE KINNATE BIOPHARMA INC. (US) 2025-03-13 WO disclosed