SCHEMBL19920076

SCHEMBL19920076

CC(C)(C)c1ccc(SC(C)(C)c2ccc(CCC(=O)O)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 7/20 0.57
▸ EPHX2 P34913 2/20 0.57
▸ RXRA P19793 1/20 0.55
▸ RXRB P28702 1/20 0.55
▸ RXRG P48443 1/20 0.55
▸ SLC13A5 Q86YT5 2/20 0.47
▸ FFAR1 O14842 2/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.44
▸ ESRRG P62508 1/20 0.43
▸ KEAP1 Q14145 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42

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
SCHEMBL19920080 0.92 RXRA (0.58) NR1H4EPHX2RXRARXRBRXRG
SCHEMBL846131 0.86 NR1H4 (0.71) NR1H4EPHX2RXRARXRBRXRG
SCHEMBL1453852 0.76 NR1H4 (0.73) NR1H4EPHX2RXRARXRBRXRG
SCHEMBL10533225 0.74 NR1H4 (0.67) NR1H4EPHX2RXRARXRBRXRG
SCHEMBL7407541 0.74 RXRA (0.58) NR1H4EPHX2RXRARXRBRXRG
SCHEMBL13778182 0.74 NR1H4 (0.54) NR1H4EPHX2RXRARXRBRXRG
SCHEMBL28481248 0.74 FFAR1 (0.58) RXRARXRBRXRGFFAR1KEAP1
SCHEMBL11387939 0.73 NR1H4 (0.55) NR1H4EPHX2RXRARXRBRXRG
SCHEMBL13558183 0.73 TSHR (0.39) NR1H4EPHX2NPSR1ALDH1A1
SCHEMBL10472979 0.73 NR1H4 (0.65) NR1H4EPHX2RXRARXRBRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10947346-B2 Polyarylene sulfide resin, method for producing same, poly(arylene sulfonium salt), and method for producing poly(arylene sulfonium salt) DIC CORPORATION (JP) 2021-03-16 — — US disclosed
US-20200157284-A1 POLYARYLENE SULFIDE RESIN, METHOD FOR PRODUCING SAME, POLY(ARYLENE SULFONIUM SALT), AND METHOD FOR PRODUCING POLY(ARYLENE SULFONIUM SALT) DAINIPPON INK & CHEMICALS (JP) 2020-05-21 — — US disclosed
US-10577464-B2 Polyarylene sulfide resin, method for producing same, poly(arylene sulfonium salt), and method for producing poly(arylene sulfonium salt) DIC CORPORATION (JP) 2020-03-03 — — US disclosed
US-20180057635-A1 POLYARYLENE SULFIDE RESIN, METHOD FOR PRODUCING SAME, POLY(ARYLENE SULFONIUM SALT), AND METHOD FOR PRODUCING POLY(ARYLENE SULFONIUM SALT) DIC CORPORATION (JP) 2018-03-01 — — US disclosed
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