SCHEMBL29437342

SCHEMBL29437342

CCN1C(=O)c2cccc3c(S(N)(=O)=O)ccc1c23

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 15/20 0.71
RORC P51449 1/20 0.67
ALDH1A1 P00352 3/20 0.67
MAPT P10636 2/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
KDM4E B2RXH2 2/20 0.67
APAF1 O14727 1/20 0.67
GAA P10253 1/20 0.67
THRB P10828 1/20 0.67
NPSR1 Q6W5P4 1/20 0.67
MEN1 O00255 1/20 0.67
PKM P14618 1/20 0.67
KMT2A Q03164 1/20 0.67
L3MBTL1 Q9Y468 2/20 0.64
ATM Q13315 1/20 0.64
HPGD P15428 1/20 0.63

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
SCHEMBL9450615 0.88 BRD4 (0.73) BRD4ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL28458415 0.87 BRD4 (0.65) BRD4RORCALDH1A1MAPTSMN1; SMN2
SCHEMBL14527675 0.86 BRD4 (0.71) BRD4ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL29437286 0.86 BRD4 (0.75) BRD4ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL16862798 0.86 BRD4 (0.75) BRD4ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL29437320 0.84 BRD4 (0.80) BRD4ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL17992491 0.84 BRD4 (0.80) BRD4ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL17992497 0.83 BRD4 (1.00) BRD4ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL11213051 0.82 BRD4 (0.65) BRD4ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL29437293 0.81 BRD4 (1.00) BRD4RORCALDH1A1MAPTSMN1; SMN2

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-111662226-B 2-oxo-1, 2-dihydrobenzo [ cd ] indole compound 中国科学院广州生物医药与健康研究院 2022-03-18 CN disclosed