SCHEMBL29065052

SCHEMBL29065052

O=C(O)c1nc(-c2cc3c(Br)cccc3n2C(F)C(F)F)no1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32

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
SCHEMBL29065003 0.80 FFAR1 (0.33) MEN1KMT2A
SCHEMBL29065110 0.80 NOTUM (0.34)
SCHEMBL30295656 0.79 MAPT (0.34) MEN1KMT2ARXFP1
SCHEMBL29065022 0.75 CYP2D6 (0.39) MEN1KMT2A
SCHEMBL29064939 0.74 PRNP (0.37) MEN1KMT2ARXFP1
SCHEMBL29064958 0.72 CYP2D6 (0.33)
SCHEMBL29065081 0.68 ALDH1A1 (0.36) MEN1KMT2A
SCHEMBL29065057 0.66 AOC2 (0.34) MEN1KMT2A
SCHEMBL24035812 0.66 HTT (0.44)
SCHEMBL29208214 0.66

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
CN-116710430-A Methods and compounds for restoring mutant p53 function 皮姆维制药公司 2023-09-05 CN disclosed