SCHEMBL30720899

SCHEMBL30720899

CCCCCc1cccnc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
LIPG Q9Y5X9 1/20 0.46
KCNH2 Q12809 1/20 0.41
ALOX5 P09917 1/20 0.41
PTGS2 P35354 1/20 0.41
GRM5 P41594 1/20 0.40
TYR P14679 1/20 0.40
BID P55957 3/20 0.39
MCL1 Q07820 3/20 0.39
BCL2L1 Q07817 2/20 0.39
BAK1 Q16611 2/20 0.39
KAT8 Q9H7Z6 2/20 0.39
TLR8 Q9NR97 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
EP300 Q09472 1/20 0.39
KAT2A Q92830 1/20 0.39
KAT2B Q92831 1/20 0.39
KAT5 Q92993 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
SCHEMBL2995646 1.00 TDP1 (0.46) TDP1L3MBTL1LIPGKCNH2ALOX5
SCHEMBL29924070 0.98 LIPG (0.49) TDP1L3MBTL1LIPGKCNH2ALOX5
SCHEMBL27289182 0.98 LIPG (0.49) TDP1L3MBTL1LIPGKCNH2ALOX5
SCHEMBL10516875 0.98 LIPG (0.49) TDP1L3MBTL1LIPGKCNH2ALOX5
SCHEMBL19997559 0.98 LIPG (0.49) TDP1L3MBTL1LIPGKCNH2ALOX5
SCHEMBL27705194 0.98 LIPG (0.49) TDP1L3MBTL1LIPGKCNH2ALOX5
SCHEMBL4302902 0.98 LIPG (0.49) TDP1L3MBTL1LIPGKCNH2ALOX5
Hydrochloric Acid SCHEMBL30610141 0.96 LIPG (0.47) TDP1L3MBTL1LIPGKCNH2ALOX5
Bromide SCHEMBL28785251 0.96 LIPG (0.47) TDP1L3MBTL1LIPGKCNH2ALOX5
Hydrochloric Acid SCHEMBL28621348 0.96 LIPG (0.47) TDP1L3MBTL1LIPGKCNH2ALOX5

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-117321046-A Indazole-based compounds and related methods of use 阿维纳斯企业公司 2023-12-29 CN disclosed