SCHEMBL29838014

SCHEMBL29838014

O=C1c2ccccc2C(=O)N1Cc1ccc(Br)c(F)n1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
PKM P14618 1/20 0.50
KMT2A Q03164 1/20 0.50
TYR P14679 2/20 0.48
CYP1B1 Q16678 9/20 0.47
MAPT P10636 1/20 0.44
RECQL P46063 1/20 0.44
CASP3 P42574 2/20 0.43
RPS6KA2 Q15349 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
GLS O94925 1/20 0.40

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
SCHEMBL26693814 1.00 MEN1 (0.50) MEN1ALDH1A1PKMKMT2ATYR
SCHEMBL8218007 0.83 ALDH1A1 (0.51) MEN1ALDH1A1PKMKMT2ATYR
SCHEMBL30498392 0.78 MEN1 (0.47) MEN1ALDH1A1PKMKMT2ATYR
SCHEMBL25757310 0.78 MEN1 (0.47) MEN1ALDH1A1PKMKMT2ATYR
SCHEMBL8377843 0.77 ALDH1A1 (0.68) MEN1ALDH1A1PKMKMT2ATYR
SCHEMBL17979238 0.77 MEN1 (0.51) MEN1ALDH1A1PKMKMT2ATYR
SCHEMBL23796073 0.76 ALDH1A1 (0.58) MEN1ALDH1A1PKMKMT2ATYR
SCHEMBL2766815 0.76 MEN1 (0.58) MEN1ALDH1A1PKMKMT2ATYR
SCHEMBL38652361 0.76 MEN1 (0.58) MEN1ALDH1A1PKMKMT2ATYR
SCHEMBL8222291 0.75 MEN1 (0.61) MEN1ALDH1A1PKMKMT2ATYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4281182-A1 GCN2 MODULATING COMPOUNDS AND USES THEREOF Hibercell, Inc. (US) 2023-11-29 EP disclosed
WO-2022159746-A1 GCN2 MODULATING COMPOUNDS AND USES THEREOF HIBERCELL, INC. (US) 2022-07-28 WO disclosed