SCHEMBL30320184

SCHEMBL30320184

CC(=O)Nc1c(Cl)cccc1C#N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.43
GAA P10253 5/20 0.43
KDM4E B2RXH2 4/20 0.43
HPGD P15428 2/20 0.43
LMNA P02545 3/20 0.42
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
GFER P55789 1/20 0.42
PTK2B Q14289 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42
TAS1R2 Q8TE23 1/20 0.42
TSHR P16473 2/20 0.41
ATM Q13315 1/20 0.41
ALOX15 P16050 2/20 0.40
HSD17B10 Q99714 2/20 0.40
GLA P06280 1/20 0.40
PDK1 Q15118 1/20 0.40

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
SCHEMBL22979896 0.85 GAA (0.43) ALDH1A1GAAKDM4EHPGDLMNA
SCHEMBL1272335 0.82 PDK1 (0.53) ALDH1A1LMNAATMHSD17B10PDK1
SCHEMBL25373430 0.80 MAPK1 (0.55) ALDH1A1GAAKDM4EHPGDLMNA
Hydrochloric Acid SCHEMBL5297660 0.80 PDK1 (0.51) ALDH1A1LMNAATMPDK1PDK2
SCHEMBL29649048 0.79 NLRP3 (0.60) ALDH1A1GAAKDM4EHPGDLMNA
SCHEMBL22987863 0.79 NLRP3 (0.60) ALDH1A1GAAKDM4EHPGDLMNA
SCHEMBL16119585 0.77 SRC (0.43) ALDH1A1GAAKDM4EHPGDLMNA
SCHEMBL30542552 0.76 KMT2A (0.48) ALDH1A1GAAKDM4EHPGDLMNA
SCHEMBL11579842 0.76 GAA (0.40) ALDH1A1GAAKDM4EHPGDLMNA
SCHEMBL3785379 0.75 ALDH1A1 (0.50) ALDH1A1GAAKDM4EHPGDLMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115974763-A Carbazole derivative and application thereof 常州大学 2023-04-18 CN claimed
CN-115974763-B Carbazole derivative and application thereof 常州大学 2025-03-11 CN disclosed
CN-115974763-A Carbazole derivative and application thereof 常州大学 2023-04-18 CN disclosed