SCHEMBL30866580

SCHEMBL30866580

Cn1c(Nc2ccc(I)cc2F)c(C(=O)O)cc(C=O)c1=O

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 19/20 0.65
MAP2K2 P36507 6/20 0.55
MAP2K5 Q13163 1/20 0.52
EIF2AK1 Q9BQI3 1/20 0.52
IDO1 P14902 1/20 0.46

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
SCHEMBL23694156 0.89 MAP2K1 (0.52) MAP2K1MAP2K2MAP2K5EIF2AK1
SCHEMBL486396 0.87 MAP2K1 (0.72) MAP2K1MAP2K2MAP2K5EIF2AK1IDO1
SCHEMBL486804 0.85 MAP2K1 (0.69) MAP2K1MAP2K2MAP2K5EIF2AK1IDO1
SCHEMBL486563 0.80 MAP2K1 (0.69) MAP2K1MAP2K2MAP2K5EIF2AK1IDO1
SCHEMBL29425363 0.80 MAP2K1 (0.69) MAP2K1MAP2K2MAP2K5EIF2AK1IDO1
SCHEMBL1776312 0.79 MAP2K1 (1.00) MAP2K1MAP2K2MAP2K5EIF2AK1IDO1
SCHEMBL23694157 0.77 MAP2K1 (0.44) MAP2K1MAP2K2MAP2K5EIF2AK1
SCHEMBL27224626 0.77 CYP2C9 (0.56) MAP2K1MAP2K2IDO1
SCHEMBL486665 0.76 MAP2K1 (0.57) MAP2K1MAP2K2MAP2K5EIF2AK1
SCHEMBL2362783 0.76 MAP2K1 (0.57) MAP2K1MAP2K2MAP2K5EIF2AK1

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
EP-4375273-A1 METHOD FOR PRODUCING ARYLAMIDE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-05-29 EP disclosed