SCHEMBL29267451

SCHEMBL29267451

O=Cc1cnc(-c2ccccc2)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LDHA P00338 2/20 0.41
NPC1 O15118 3/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
SMO Q99835 3/20 0.40
CNR1 P21554 1/20 0.38
IDO1 P14902 1/20 0.38
TDO2 P48775 1/20 0.38
RAB9A P51151 2/20 0.38
KMO O15229 1/20 0.38
GSK3A P49840 1/20 0.37
GSK3B P49841 1/20 0.37
BAZ2B Q9UIF8 1/20 0.37
ADORA3 P0DMS8 1/20 0.37

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
SCHEMBL25833660 0.80 GRM5 (0.41) KMO
SCHEMBL17979362 0.74 TRPA1 (0.34) ALDH1A1SMN1; SMN2TDP1
SCHEMBL4876024 0.73 LDHA (0.47) LDHAMEN1ALDH1A1KMT2ACNR1
SCHEMBL31748742 0.73 HPGD (0.44) LDHANPC1MEN1ALDH1A1HPGD
SCHEMBL19434146 0.73 LDHA (0.53) LDHANPC1MEN1ALDH1A1HPGD
SCHEMBL8549213 0.72 JAK2 (0.40) NPC1MEN1ALDH1A1KMT2ATDP1
SCHEMBL899188 0.71 TDP1 (0.45) NPC1MEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL29411195 0.71 TDP1 (0.45) NPC1MEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL30996251 0.71 ALOX5AP (0.36) LDHANPC1MEN1ALDH1A1HPGD
SCHEMBL400693 0.71 ALDH1A1 (0.41) NPC1MEN1ALDH1A1HPGDKMT2A

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
CN-118324761-A USP inhibitor, preparation method and application thereof 北京华森英诺生物科技有限公司 2024-07-12 CN disclosed