SCHEMBL23633170

SCHEMBL23633170

Cn1c(CCOS(C)(=O)=O)nc2ccc(Br)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.39
MAPT P10636 4/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
NPC1 O15118 4/20 0.39
USP2 O75604 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPK1 P28482 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
NTRK1 P04629 1/20 0.38
NTRK2 Q16620 1/20 0.38
GFER P55789 1/20 0.37
HDAC6 Q9UBN7 1/20 0.36
HDAC1 Q13547 1/20 0.36
ACACB O00763 1/20 0.36
RECQL P46063 1/20 0.35
FABP4 P15090 1/20 0.35

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
SCHEMBL15112092 0.82 RAB9A (0.46) RAB9AMAPTMEN1KMT2ANPC1
SCHEMBL31228798 0.82 RAB9A (0.46) RAB9AMAPTMEN1KMT2ANPC1
SCHEMBL30461655 0.79 CYP1A2 (0.36) RAB9AMAPTMEN1KMT2ANPC1
SCHEMBL25420820 0.79 CYP1A2 (0.36) RAB9AMAPTMEN1KMT2ANPC1
SCHEMBL28807168 0.78 RAB9A (0.40) RAB9AMAPTMEN1KMT2ANPC1
SCHEMBL29241804 0.78 NTRK1 (0.40) RAB9AMAPTMEN1KMT2ANPC1
SCHEMBL15111986 0.78 PPARG (0.46) RAB9AMAPTMEN1KMT2ANPC1
SCHEMBL23638268 0.76 MAPT (0.43) RAB9AMAPTMEN1KMT2ANPC1
SCHEMBL30173147 0.76 MAPT (0.43) RAB9AMAPTMEN1KMT2ANPC1
SCHEMBL17673776 0.76 MAPT (0.43) RAB9AMAPTMEN1KMT2ANPC1

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
CN-114901664-A Pyridone compound and application thereof 江苏先声药业有限公司 2022-08-12 CN disclosed
WO-2021139775-A1 PYRIDONE COMPOUND AND APPLICATION 江苏先声药业有限公司 2021-07-15 WO disclosed