SCHEMBL17936671

SCHEMBL17936671

CS(=O)(=O)c1ccc(S(=O)(=O)c2ccc(S(=O)(=O)c3ccc(S(=O)(=O)c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 2/20 0.70
▸ PTGS2 P35354 7/20 0.59
▸ ENPP2 Q13822 2/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ MAPT P10636 2/20 0.52
▸ POLB P06746 1/20 0.52
▸ GAA P10253 2/20 0.50
▸ HSD11B1 P28845 1/20 0.48
▸ HTT P42858 1/20 0.48

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
SCHEMBL7655181 1.00 HTR6 (0.70) HTR6PTGS2ENPP2SMN1; SMN2ALDH1A1
Methylphenylsulfone SCHEMBL1332357 0.89 PTGS2 (0.62) HTR6PTGS2ENPP2SMN1; SMN2ALDH1A1
SCHEMBL17548700 0.89 ENPP2 (0.62) HTR6PTGS2ENPP2ALDH1A1GAA
Methylphenylsulfone SCHEMBL78253 0.89 PTGS2 (0.62) HTR6PTGS2ENPP2SMN1; SMN2ALDH1A1
SCHEMBL8941534 0.88 HTT (0.68) HTR6PTGS2SMN1; SMN2ALDH1A1HTT
SCHEMBL17287077 0.88 HTT (0.68) HTR6PTGS2SMN1; SMN2ALDH1A1HTT
(Phenylsulfonyl)Benzene SCHEMBL10870153 0.87 HTR6 (0.82) HTR6SMN1; SMN2ALDH1A1MAPTPOLB
Methylphenylsulfone SCHEMBL5499087 0.87 PTGS2 (0.60) HTR6PTGS2ENPP2SMN1; SMN2ALDH1A1
SCHEMBL5051390 0.87 HTR6 (0.93) HTR6SMN1; SMN2ALDH1A1MAPTPOLB
Methylphenylsulfone SCHEMBL28046614 0.84 PTGS2 (0.58) HTR6PTGS2ENPP2SMN1; SMN2ALDH1A1

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
US-9670325-B2 Nanomodified backbones for polyimides with difunctional and mixed-functionality endcaps THE BOEING COMPANY (US) 2017-06-06 — — US disclosed
US-20160208053-A1 NANOMODIFIED BACKBONES FOR POLYIMIDES WITH DIFUNCTIONAL AND MIXED-FUNCTIONALITY ENDCAPS THE BOEING COMPANY 2016-07-21 — — US disclosed
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