SCHEMBL28002154

SCHEMBL28002154

O=C(c1ccccc1)C1CC1.O=S(=O)(Cl)Cl

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.51
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
HTR2A P28223 2/20 0.49
CPB1 P15086 1/20 0.49
ALDH1A1 P00352 2/20 0.48
HTR2C P28335 1/20 0.48
HTR2B P41595 1/20 0.48
HSD11B1 P28845 1/20 0.47
SLC18A3 Q16572 2/20 0.46
KCNH2 Q12809 1/20 0.45
MCL1 Q07820 1/20 0.44

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
SCHEMBL18428493 0.89 HTR2A (0.56) MGLLKMT2AMEN1HTR2ACPB1
SCHEMBL324342 0.89 HTR2A (0.56) MGLLKMT2AMEN1HTR2ACPB1
Bicarbonate SCHEMBL11468689 0.87 HTR2A (0.54) MGLLKMT2AMEN1HTR2ACPB1
SCHEMBL3515355 0.83 NPC1 (0.52) MGLLKMT2AMEN1HTR2ACPB1
SCHEMBL439217 0.83 NPC1 (0.52) MGLLKMT2AMEN1HTR2ACPB1
Acetic Acid SCHEMBL2762930 0.83 HTR2A (0.51) MGLLKMT2AMEN1HTR2ACPB1
SCHEMBL407216 0.83 NPC1 (0.52) MGLLKMT2AMEN1HTR2ACPB1
SCHEMBL26883 0.82 SLC18A3 (0.51) MGLLKMT2AMEN1HTR2ACPB1
SCHEMBL3113279 0.81 SRD5A2 (0.58) MGLLKMT2AMEN1HTR2ACPB1
SCHEMBL965420 0.81 SRD5A2 (0.63) MGLLKMT2AMEN1HTR2ACPB1

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
CN-104395297-B Sulfonamide derivatives and pharmaceutical use thereof AJINOMOTO CO.,INC. (JP) 2016-05-04 CN disclosed
CN-104395297-A Sulfonamide derivatives and pharmaceutical use thereof AJINOMOTO KK 2015-03-04 CN disclosed