SCHEMBL38660409

SCHEMBL38660409

Cc1ccc(CSCCO)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
MAPT P10636 3/20 0.38
RAB9A P51151 3/20 0.38
TP53 P04637 2/20 0.38
NPC1 O15118 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
ADORA2A P29274 1/20 0.38
PYCR1 P32322 1/20 0.37
LMNA P02545 4/20 0.36
THRB P10828 1/20 0.36
HTT P42858 1/20 0.36
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
HPGD P15428 2/20 0.35
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL30753728 0.88 MAPT (0.41) CYP1A2CYP2C9MAPTRAB9ATP53
SCHEMBL29196191 0.84 MAPT (0.43) CYP1A2CYP2C9MAPTRAB9ATP53
SCHEMBL29279069 0.79 MAPT (0.40) CYP1A2CYP2C9MAPTRAB9ATP53
SCHEMBL3678782 0.74 TP53 (0.44) MAPTRAB9ATP53NPC1SMN1; SMN2
SCHEMBL30585189 0.74 TP53 (0.44) MAPTRAB9ATP53NPC1SMN1; SMN2
SCHEMBL30585190 0.74 TP53 (0.44) MAPTRAB9ATP53NPC1SMN1; SMN2
SCHEMBL1146137 0.74 MAPT (0.42) CYP1A2CYP2C9MAPTRAB9ATP53
SCHEMBL95787 0.73 TP53 (0.48) MAPTRAB9ATP53NPC1SMN1; SMN2
SCHEMBL29818192 0.73 TAAR1 (0.50) CYP1A2MAPTRAB9ATP53NPC1
SCHEMBL96044 0.73 TAAR1 (0.50) CYP1A2MAPTRAB9ATP53NPC1

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-122039074-A Method for preparing sulfoxide compound by electrochemical microchannel continuous flow oxidation 南京工业大学 2026-05-15 CN disclosed