SCHEMBL21060836

SCHEMBL21060836

O=C1CCCC(S(=O)(=O)c2ccc(C(F)(F)F)cc2)C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.41
PTGS1 P23219 1/20 0.41
MAPT P10636 1/20 0.41
KIF11 P52732 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
CYP1A2 P05177 1/20 0.38
CCR6 P51684 2/20 0.37
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ELOVL6 Q9H5J4 2/20 0.36
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL21060841 0.83 ALDH1A1 (0.45) PTGS2PTGS1MAPTMMP2MMP9
SCHEMBL21060838 0.80 MAPT (0.63) MAPTHTR2AHTR2CALDH1A1MEN1
SCHEMBL2421051 0.73 CCR6 (0.48) PTGS2PTGS1KIF11HTR2AHTR2C
SCHEMBL15531739 0.72 HTR6 (0.49) PTGS2PTGS1MAPTKIF11HTR2A
SCHEMBL21060840 0.71
SCHEMBL15537965 0.70 LMNA (0.39) PTGS2KIF11CCR6ALDH1A1MEN1
SCHEMBL21060835 0.68 ADRA2A (0.30)
SCHEMBL29924839 0.68 CYP26A1 (0.47) MAPTHTR2AHTR2CELOVL6
SCHEMBL14231083 0.67 HTR6 (0.41) PTGS2PTGS1KIF11HTR2AHTR2C
SCHEMBL412236 0.67 CES2 (0.39) CYP1A2ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11884839-B2 Acetal-protected silanol group-containing polysiloxane composition NISSAN CHEMICAL CORPORATION (JP) 2024-01-30 US disclosed
CN-109563371-B Polysiloxane composition comprising acetal-protected silanol groups 日产化学株式会社 2021-09-21 CN disclosed
US-20190185707-A1 ACETAL-PROTECTED SILANOL GROUP-CONTAINING POLYSILOXANE COMPOSITION NISSAN CHEMICAL CORPORATION (JP) 2019-06-20 US disclosed