SCHEMBL29926224

SCHEMBL29926224

Cc1[nH]c2c(N)cccc2c1C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 2/20 0.64
MAPT P10636 4/20 0.51
NPC1 O15118 1/20 0.51
MAPK1 P28482 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
PARP1 P09874 4/20 0.48
CYP3A4 P08684 4/20 0.46
TSHR P16473 3/20 0.46
PIK3CA P42336 1/20 0.46
POLB P06746 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
KDM4E B2RXH2 3/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
LMNA P02545 1/20 0.45
BLM P54132 1/20 0.45
MCL1 Q07820 1/20 0.45
ALDH1A1 P00352 3/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42

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
SCHEMBL1011288 1.00 AHR (0.64) AHRMAPTNPC1MAPK1L3MBTL1
SCHEMBL5341593 0.78 AHR (1.00) AHRMAPTNPC1MAPK1L3MBTL1
SCHEMBL8650444 0.77 MAPT (0.44) AHRMAPTPARP1CYP3A4TSHR
SCHEMBL30983620 0.77 PARP1 (0.65) MAPTPARP1CYP3A4TSHRPIK3CA
SCHEMBL3073008 0.77 PARP1 (0.65) MAPTPARP1CYP3A4TSHRPIK3CA
SCHEMBL8030947 0.77 ALDH1A1 (0.55) AHRMAPTNPC1MAPK1L3MBTL1
SCHEMBL6185787 0.76 MCL1 (0.62) MAPTNPC1L3MBTL1PARP1CYP3A4
Hydrochloric Acid SCHEMBL9445592 0.75 ALDH1A1 (0.53) AHRMAPTNPC1MAPK1L3MBTL1
SCHEMBL21646227 0.75 AHR (0.64) AHRMAPTNPC1MAPK1L3MBTL1
SCHEMBL5503927 0.75 AHR (0.64) AHRMAPTNPC1MAPK1L3MBTL1

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-115087658-A Sulfonamide or sulfenamide compounds having BRD 4-inducing proteolytic activity, and pharmaceutical use thereof 田边三菱制药株式会社 2022-09-20 CN disclosed