SCHEMBL38660311

SCHEMBL38660311

C[S+]([O-])c1ccc(C(=O)O)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.53
CASP1 P29466 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
MYC P01106 2/20 0.46
NR4A1 P22736 1/20 0.46
ALDH1A1 P00352 2/20 0.42
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.40
XDH P47989 1/20 0.40
NOTUM Q6P988 5/20 0.37
NR1H4 Q96RI1 1/20 0.37
ERCC5 P28715 1/20 0.37
FEN1 P39748 1/20 0.37
SRD5A2 P31213 1/20 0.37
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
PDK2 Q15119 1/20 0.36
CTSB P07858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL27408073 0.86 TSHR (0.36) TSHRCASP1SMN1; SMN2MYCNR4A1
SCHEMBL22895025 0.81 ABL1 (0.45) TSHRCASP1SMN1; SMN2ALDH1A1LMNA
SCHEMBL38658544 0.80 RXRB (0.42) TSHRMYCALDH1A1NOTUMNR1H4
SCHEMBL10381236 0.79 LCK (0.41) TSHRSMN1; SMN2MYCNR4A1ALDH1A1
SCHEMBL8192681 0.75 CYP3A4 (0.41) ALDH1A1LMNANOTUM
SCHEMBL9629178 0.74 AHR (0.40) TSHRALDH1A1TP53
SCHEMBL11818340 0.73 CA12 (0.43) TSHRCASP1SMN1; SMN2MYCNR4A1
SCHEMBL6996590 0.72 ALDH1A1 (0.47) MYCALDH1A1LMNATDP1
SCHEMBL20826491 0.72 ACE2 (0.34) LMNANOTUM
SCHEMBL4930243 0.71 ALDH1A1 (0.49) TSHRSMN1; SMN2ALDH1A1LMNATP53

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