SCHEMBL23401768

SCHEMBL23401768

Cc1ccc(-c2c(O)nn(CC(C)C)c2-c2ccc(C)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.36
NR3C2 P08235 1/20 0.36
AR P10275 1/20 0.36
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
USP7 Q93009 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
RAB9A P51151 1/20 0.33
DPP4 P27487 5/20 0.32
DPP8 Q6V1X1 2/20 0.32
GCGR P47871 1/20 0.32
ICMT O60725 1/20 0.32
DPP9 Q86TI2 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
SCHEMBL23400299 0.94 CNR2 (0.39) PGRNR3C2ARMEN1KMT2A
SCHEMBL23399172 0.94 CNR2 (0.39) PGRNR3C2ARMEN1KMT2A
SCHEMBL23401198 0.88 ICMT (0.37) PGRNR3C2ARMEN1KMT2A
SCHEMBL23399710 0.86 MEN1 (0.34) MEN1KMT2AUSP7NPC1ALDH1A1
SCHEMBL23401131 0.86 MEN1 (0.34) PGRNR3C2ARMEN1KMT2A
SCHEMBL23403583 0.86 CNR2 (0.40) PGRNR3C2ARALDH1A1MAPT
SCHEMBL23401896 0.84 GCGR (0.34) MEN1KMT2AUSP7NPC1ALDH1A1
SCHEMBL23403589 0.83 MAPT (0.41) PGRNR3C2USP7HTR2AHTR2C
SCHEMBL23401942 0.82 GRIA2 (0.37) MEN1KMT2AUSP7NPC1ALDH1A1
SCHEMBL23403072 0.82 USP7 (0.34) PGRNR3C2ARMEN1KMT2A

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