SCHEMBL23402170

SCHEMBL23402170

CCn1[nH]c(-c2cccc(C)c2)c(-c2ccccc2)c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALKBH3 Q96Q83 1/20 0.44
THRB P10828 1/20 0.41
KMT2A Q03164 3/20 0.40
MAPK14 Q16539 3/20 0.40
MAT2A P31153 4/20 0.40
GAA P10253 2/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
ALOX15 P16050 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL23401761 0.93 MAPK14 (0.41) ALKBH3THRBKMT2AMAPK14MEN1
SCHEMBL23403082 0.89 ALKBH3 (0.42) ALKBH3THRBKMT2AMAT2AGAA
SCHEMBL23399028 0.87 KMT2A (0.50) ALKBH3THRBKMT2AMAT2AMEN1
SCHEMBL23398953 0.87 MAT2A (0.46) ALKBH3KMT2AMAT2AGAAMEN1
SCHEMBL23402118 0.86 ALKBH3 (0.45) ALKBH3KMT2AMAT2AGAAMEN1
SCHEMBL23401938 0.86 ALKBH3 (0.45) ALKBH3KMT2AMAT2AGAAMEN1
SCHEMBL23400715 0.85 ALKBH3 (0.41) ALKBH3THRBKMT2AMAT2AGAA
SCHEMBL23398773 0.84 MAPK14 (0.42) ALKBH3KMT2AMAPK14MEN1NPC1
SCHEMBL23398851 0.83 ALKBH3 (0.39) ALKBH3THRBKMT2AMAPK14ALDH1A1
SCHEMBL23399430 0.82 MAPK14 (0.40) THRBKMT2AMAPK14MEN1NPC1

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