SCHEMBL38650902

SCHEMBL38650902

COC(=O)CC1c2ccc(F)cc2N(C)S(=O)(=O)c2ccc(C)cc21

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
CHRM3 P20309 7/20 0.35
CAPN1 P07384 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
SLC10A2 Q12908 3/20 0.33
KMT2A Q03164 1/20 0.33
HTR7 P34969 1/20 0.32
NOD2 Q9HC29 1/20 0.32
NOD1 Q9Y239 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32

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
SCHEMBL38650987 0.88 KMT2A (0.35) MAPTKMT2A
SCHEMBL38650820 0.88 RXFP1 (0.40) MAPTKMT2A
SCHEMBL38650983 0.88 HTT (0.39) MAPTL3MBTL1KMT2ACTDSP1
SCHEMBL38651056 0.86 ALDH1A1 (0.39) MAPTKMT2A
SCHEMBL38651026 0.85 NR1I2 (0.38) MAPTCAPN1KMT2A
SCHEMBL38650920 0.77 CYP1A2 (0.40) MAPTL3MBTL1KMT2A
SCHEMBL38650874 0.76 ALDH1A1 (0.38) MAPTKMT2A
SCHEMBL38650904 0.76 ALDH1A1 (0.38) MAPTKMT2A
SCHEMBL38650792 0.74 CYP1A2 (0.46) MAPTKMT2ACTDSP1
SCHEMBL38650796 0.74 EGFR (0.43) MAPT

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