SCHEMBL8322952

SCHEMBL8322952

CC[Si](CC)(CC)Oc1ccc(-c2cccc(S)c2-c2ccc(O[Si](CC)(CC)CC)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 1/20 0.35
PPARG P37231 2/20 0.32
PPARA Q07869 2/20 0.32
HEXA P06865 1/20 0.31
HEXB P07686 1/20 0.31
HDAC4 P56524 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
ABL1 P00519 1/20 0.30
ABCB1 P08183 1/20 0.30
BCR P11274 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA7 P36544 1/20 0.30

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
SCHEMBL8648344 0.82 PTGS2 (0.38)
SCHEMBL8325636 0.82 BRD4 (0.36)
SCHEMBL6267998 0.78 ABL1 (0.50) ENPP1HDAC4HDAC2HDAC8ABL1
Bromide SCHEMBL3130114 0.77 ABL1 (0.49) ENPP1HDAC4HDAC2HDAC8ABL1
SCHEMBL8320059 0.76 PPARG (0.33) ENPP1PPARGPPARAHDAC4HDAC2
SCHEMBL9333532 0.75 RARB (0.50)
SCHEMBL2437397 0.75 RARB (0.50)
SCHEMBL246926 0.74 PPARG (0.38) ENPP1PPARGPPARAHDAC4HDAC2
Methane SCHEMBL3419259 0.74 RARB (0.49)
SCHEMBL482553 0.72 ENPP1 (0.44) ENPP1HEXAHEXB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5880169-A HAVING HIGH RESOLUTION FOR FINE PATTERNING SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-03-09 US disclosed