SCHEMBL8664950

SCHEMBL8664950

Cc1ccc(S(=O)(=O)OCC=Cc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.50
CYP24A1 Q07973 1/20 0.47
ALDH1A1 P00352 4/20 0.45
IDO1 P14902 2/20 0.45
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
VDR P11473 1/20 0.44
HTT P42858 3/20 0.44
MAPK1 P28482 1/20 0.43
RECQL P46063 1/20 0.41
OPRM1 P35372 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 1/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
STAT3 P40763 1/20 0.40
CYP1B1 Q16678 1/20 0.40

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
SCHEMBL8664947 1.00 PPARG (0.50) PPARGCYP24A1ALDH1A1IDO1KDM4E
Piperazine SCHEMBL11840225 0.93 PPARG (0.45) PPARGCYP24A1ALDH1A1IDO1KDM4E
SCHEMBL11811699 0.89 IDO1 (0.52) PPARGALDH1A1IDO1KDM4EKMT2A
SCHEMBL11811697 0.89 IDO1 (0.52) PPARGALDH1A1IDO1KDM4EKMT2A
SCHEMBL6964397 0.85 PPARG (0.48) PPARGCYP24A1ALDH1A1IDO1KDM4E
SCHEMBL9470886 0.84 HDAC8 (0.39) PPARGCYP24A1ALDH1A1KDM4EMEN1
SCHEMBL7697212 0.84 G6PD (0.47) ALDH1A1KMT2AVDRHTTSMN1; SMN2
SCHEMBL7694213 0.84 G6PD (0.47) ALDH1A1KMT2AVDRHTTSMN1; SMN2
SCHEMBL7694210 0.84 G6PD (0.47) ALDH1A1KMT2AVDRHTTSMN1; SMN2
SCHEMBL9676862 0.83 CYP24A1 (0.54) PPARGCYP24A1ALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0881205-A1 Method for production of allyloxystyrene compounds LOCTITE CORPORATION (US) 1998-12-02 EP claimed
US-5633411-A Method for production of allyloxystyrene compounds LOCTITE CORPORATION (US) 1997-05-27 US claimed
CN-119100962-A Se-deuterated methylation or Se-13Application of C methylation reagent 浙江工业大学 2024-12-10 CN disclosed
EP-0881205-A1 Method for production of allyloxystyrene compounds LOCTITE CORPORATION (US) 1998-12-02 EP disclosed
US-5633411-A Method for production of allyloxystyrene compounds LOCTITE CORPORATION (US) 1997-05-27 US disclosed
US-4068070-A ANGINA PECTORIS FUJI CHEMICAL INDUSTRY CO., LTD. (JA) 1978-01-10 US disclosed
US-3962247-A ANGINA PECTORIS FUJI CHEMICAL INDUSTRY CO., LTD. (JA) 1976-06-08 US disclosed