SCHEMBL9615869

SCHEMBL9615869

O=S(=O)(F)c1cccc(S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.61
ALDH1A1 P00352 5/20 0.53
LMNA P02545 3/20 0.53
TSHR P16473 2/20 0.53
THRB P10828 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
SMN1; SMN2 Q16637 4/20 0.48
MAPT P10636 2/20 0.47
POLB P06746 1/20 0.47
HTR2C P28335 2/20 0.46
HTR2A P28223 1/20 0.46
KCNH2 Q12809 1/20 0.46
APOBEC3G Q9HC16 1/20 0.45
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
HPGD P15428 1/20 0.44
RAB9A P51151 1/20 0.44
HTR2B P41595 1/20 0.43

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
SCHEMBL9140147 0.89 HTR6 (0.78) HTR6ALDH1A1LMNATSHRTHRB
SCHEMBL28709181 0.89 HTR6 (0.78) HTR6ALDH1A1LMNATSHRTHRB
SCHEMBL10571503 0.86 CA2 (0.55) HTR6ALDH1A1LMNATSHRSMN1; SMN2
SCHEMBL1332008 0.81 HTR6 (0.82) HTR6ALDH1A1LMNATSHRTHRB
SCHEMBL8014338 0.79 CA2 (0.48) HTR6ALDH1A1LMNATSHRSMN1; SMN2
SCHEMBL415483 0.78 SMN1; SMN2 (0.62) HTR6ALDH1A1LMNATSHRTHRB
SCHEMBL13029818 0.78 HTR6 (0.61) HTR6ALDH1A1LMNATSHRTHRB
SCHEMBL4617855 0.78 CA2 (0.74) HTR6ALDH1A1LMNATSHRTHRB
SCHEMBL31540998 0.78 SMN1; SMN2 (0.62) HTR6ALDH1A1LMNATSHRTHRB
SCHEMBL8576301 0.78 ALDH1A1 (0.62) HTR6ALDH1A1LMNATSHRTHRB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4099760-A None JP disclosed
JP-H0499760-A DI(ALKYLPHENYL) SULFONESULFONYL HALIDE AND SYNTHESIS THEREOF AGENCY OF IND SCIENCE & TECHNOL 1992-03-31 JP disclosed