SCHEMBL24327170

SCHEMBL24327170

Cc1csc(-c2ccc(CNC=O)cc2)c1C

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.43
ADH1C P00326 1/20 0.43
ADH1A P07327 1/20 0.43
ADH7 P40394 1/20 0.43
VHL P40337 1/20 0.39
ALOX5 P09917 1/20 0.38
ADRB2 P07550 1/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
CASP3 P42574 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
PDCD1 Q15116 1/20 0.31
CD274 Q9NZQ7 1/20 0.31

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
SCHEMBL20111720 0.78 VHL (0.64) ADH1BADH1CADH1AADH7VHL
SCHEMBL13799002 0.76 NPC1 (0.37) NPC1RAB9AMAPTHPGDCASP3
SCHEMBL24440138 0.75 NPC1 (0.40) VHLALOX5NPC1RAB9AMAPT
SCHEMBL20111748 0.74 ADH1B (0.44) ADH1BADH1CADH1AADH7VHL
SCHEMBL24327094 0.74 HRH3 (0.46) ADRB2PDCD1CD274
SCHEMBL8763196 0.72 ADH1B (0.76) ADH1BADH1CADH1AADH7ALOX5
SCHEMBL31566 0.70 ADH1B (0.61) ADH1BADH1CADH1AADH7NPC1
SCHEMBL1691160 0.68 ADH1B (0.76) ADH1BADH1CADH1AADH7RAB9A
SCHEMBL5451697 0.68 ADH1B (0.76) ADH1BADH1CADH1AADH7RAB9A
SCHEMBL22157991 0.67 NPC1 (0.49) ALOX5NPC1RAB9AMAPTHPGD

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
WO-2022068933-A1 COMPOUNDS AND METHODS OF TREATING DISEASES CULLGEN (SHANGHAI) , INC. (CN) 2022-04-07 WO disclosed