SCHEMBL38650718

SCHEMBL38650718

COC(=O)CC1c2ccccc2N(C)S(=O)(=O)c2ccc(C(C)C)cc21

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.38
TP53 P04637 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
NR1I2 O75469 3/20 0.37
OPRM1 P35372 1/20 0.37
DRD3 P35462 1/20 0.37
OPRD1 P41143 1/20 0.37
EGFR P00533 1/20 0.37
RAB9A P51151 1/20 0.35
HTR1A P08908 1/20 0.33
HTR7 P34969 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL38651056 0.86 ALDH1A1 (0.39) MAPTTP53NR1I2OPRM1DRD3
SCHEMBL38650796 0.85 EGFR (0.43) MAPTNR1I2OPRM1DRD3OPRD1
SCHEMBL38650960 0.85 MEN1 (0.41) MAPTTP53NR1I2OPRM1DRD3
SCHEMBL38651026 0.85 NR1I2 (0.38) MAPTRXFP1NR1I2OPRM1DRD3
SCHEMBL38651042 0.85 NR1I2 (0.48) MAPTNR1I2OPRM1DRD3OPRD1
SCHEMBL38650792 0.85 CYP1A2 (0.46) MAPTNR1I2OPRM1DRD3OPRD1
SCHEMBL38650882 0.84 NR1I2 (0.39) MAPTNR1I2OPRM1DRD3OPRD1
SCHEMBL38650963 0.84 NR1I2 (0.38) MAPTNR1I2OPRM1DRD3OPRD1
SCHEMBL38650826 0.83 ALDH1A1 (0.42) MAPTNR1I2OPRM1DRD3OPRD1
SCHEMBL38650742 0.79 NR1I2 (0.42) MAPTTP53NR1I2OPRM1DRD3

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-122010870-A Ester group substitution dibenzothio of (C) Synthesis method of azepine derivative 新疆大学 2026-05-12 CN disclosed