SCHEMBL30187653

SCHEMBL30187653

Nc1cccc(-c2cccs2)c1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
KCNH2 Q12809 1/20 0.43
KDM4E B2RXH2 5/20 0.42
ALDH1A1 P00352 5/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 3/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
LTA4H P09960 2/20 0.40
ATM Q13315 1/20 0.40
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.40
LTK P29376 1/20 0.40
CDK5 Q00535 1/20 0.40
MST1R Q04912 1/20 0.40
DYRK1A Q13627 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
SCHEMBL15365507 0.80 TDO2 (0.46) TDO2ADORA3KCNH2KDM4EALDH1A1
SCHEMBL1284851 0.80 ALDH1A1 (0.49) TDO2KDM4EALDH1A1NPC1RAB9A
SCHEMBL1060974 0.79 ADORA3 (0.56) TDO2ADORA3KCNH2KDM4EALDH1A1
SCHEMBL24181830 0.77 LTK (0.40) TDO2KDM4EALDH1A1NPC1RAB9A
SCHEMBL13029774 0.77 ALDH1A1 (0.44) TDO2ADORA3KCNH2KDM4EALDH1A1
SCHEMBL28746780 0.77 TSHR (0.48) TDO2ADORA3KCNH2KDM4EALDH1A1
SCHEMBL4196237 0.76 ALDH1A1 (0.50) KDM4EALDH1A1NPC1RAB9AL3MBTL1
SCHEMBL31607601 0.76 ALDH1A1 (0.50) KDM4EALDH1A1NPC1RAB9AL3MBTL1
SCHEMBL5776802 0.73 ADORA1 (0.55) ADORA3KDM4EALDH1A1NPC1RAB9A
SCHEMBL2009428 0.73 KCNH2 (0.50) TDO2ADORA3KCNH2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115611868-B Furanamide derivative and preparation method and application thereof 山东大学 2024-07-23 CN claimed
CN-115611868-A Furanamide derivative and preparation method and application thereof 山东大学 2023-01-17 CN claimed
CN-115611868-B Furanamide derivative and preparation method and application thereof 山东大学 2024-07-23 CN disclosed
CN-115611868-A Furanamide derivative and preparation method and application thereof 山东大学 2023-01-17 CN disclosed