SCHEMBL23403255

SCHEMBL23403255

Cc1ccc(-n2[nH]c(-c3ccccc3C)c(C)c2=O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.52
TP53 P04637 1/20 0.45
ALDH1A1 P00352 4/20 0.41
PGR P06401 1/20 0.41
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
KDM4E B2RXH2 2/20 0.40
PKM P14618 2/20 0.40
LMNA P02545 2/20 0.40
POLB P06746 1/20 0.40
CRHBP P24387 1/20 0.40
OPRK1 P41145 1/20 0.40
CCR6 P51684 1/20 0.40
CRHR2 Q13324 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
GAA P10253 3/20 0.39
TLR9 Q9NR96 1/20 0.39
MPI P34949 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
SCHEMBL23402263 0.91 MAPT (0.53) MAPTTP53ALDH1A1MEN1KMT2A
SCHEMBL23400871 0.86 MAPT (0.48) MAPTTP53ALDH1A1PGRMEN1
SCHEMBL23399944 0.84 MAPT (0.52) MAPTTP53ALDH1A1MEN1KMT2A
SCHEMBL23403185 0.84 MAPT (0.55) MAPTTP53ALDH1A1MEN1KMT2A
SCHEMBL23398725 0.83 GAA (0.55) MAPTTP53ALDH1A1MEN1KMT2A
SCHEMBL23401886 0.81 MAPT (0.41) MAPTTP53ALDH1A1MEN1KMT2A
SCHEMBL23401709 0.81 ALKBH3 (0.55) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL23402714 0.81 MAPT (0.46) MAPTTP53ALDH1A1MEN1KMT2A
SCHEMBL23399443 0.80 GAA (0.55) MAPTTP53ALDH1A1MEN1KMT2A
SCHEMBL23402482 0.79 ALKBH3 (0.46) MAPTTP53ALDH1A1MEN1KMT2A

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-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed