SCHEMBL20357367

SCHEMBL20357367

CC(Cc1ccc(O[Si](C)(C)C(C)(C)C)cc1)N=C=O

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PREP P48147 4/20 0.39
CA12 O43570 4/20 0.39
CA1 P00915 4/20 0.39
CA9 Q16790 4/20 0.39
APLNR P35414 1/20 0.33
ACACB O00763 2/20 0.32
SLC6A4 P31645 1/20 0.31

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
SCHEMBL11332023 0.80 MIF (0.40) PREPCA12CA1CA9ACACB
SCHEMBL21753640 0.78 TSHR (0.35) SLC6A4
SCHEMBL5710769 0.78 TSHR (0.35) SLC6A4
SCHEMBL13080679 0.75 TP53 (0.55) PREPCA12CA1CA9APLNR
SCHEMBL19994229 0.74 LDHA (0.39) ACACB
SCHEMBL13535171 0.73 PREP (0.40) PREPCA12CA1CA9ACACB
SCHEMBL9848674 0.72 CYP1A2 (0.47) PREPCA12CA1CA9
SCHEMBL13080680 0.72 PREP (0.42) PREPCA12CA1CA9ACACB
SCHEMBL14728212 0.71 LDHA (0.44) PREPCA12CA1CA9
SCHEMBL7906238 0.71 PREP (0.43) PREPCA12CA1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3345954-B1 POLYROTAXANE, PRODUCTION METHOD THEREFOR, AND OPTICAL COMPOSITION CONTAINING SAID POLYROTAXANE TOKUYAMA CORP (JP) 2023-07-05 EP disclosed
US-11578174-B2 Polyrotaxane, production method therefor, and optical composition containing said polyrotaxane TOKUYAMA CORPORATION (JP) 2023-02-14 US disclosed
CN-111154056-B Optical composition containing polyrotaxane 株式会社德山 2021-12-21 CN disclosed
CN-107922605-B Polyrotaxane, process for producing the same, and optical composition containing the same 株式会社德山 2020-12-11 CN disclosed
CN-111154056-A Optical composition containing polyrotaxane 株式会社德山 2020-05-15 CN disclosed
US-20200071467-A1 Polyrotaxane, Production Method Therefor, and Optical Composition Containing said Polyrotaxane TOKUYAMA CORPORATION (JP) 2020-03-05 US disclosed
US-20180312643-A1 Polyrotaxane, Production Method Therefor, and Optical Composition Containing said Polyrotaxane TOKUYAMA CORPORATION (JP) 2018-11-01 US disclosed
EP-3345954-A1 POLYROTAXANE, PRODUCTION METHOD THEREFOR, AND OPTICAL COMPOSITION CONTAINING SAID POLYROTAXANE Tokuyama Corporation (JP) 2018-07-11 EP disclosed