SCHEMBL9765048

SCHEMBL9765048

C=CC(=O)OC(C)CC[Si](C)(C)O[Si](C)(C)CCC(C)OC(=O)C=C

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.39
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31
HPGD P15428 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
SCHEMBL9303128 0.93 TSHR (0.37) TSHRALDH1A1TP53CYP3A4HIF1A
SCHEMBL19712271 0.88 TSHR (0.38) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL20485651 0.88 TSHR (0.40) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL16415000 0.86 TSHR (0.41) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL10429553 0.85 TSHR (0.36) TSHRALDH1A1TP53CYP3A4MAPK1
Ammonia Solution, Strong SCHEMBL28181275 0.84 TSHR (0.40) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL28338316 0.84 TSHR (0.35) TSHR
SCHEMBL9302432 0.83 TSHR (0.37) TSHRALDH1A1TP53CYP3A4HIF1A
SCHEMBL9304001 0.83 TSHR (0.37) TSHRALDH1A1TP53CYP3A4HIF1A
Hydrochloric Acid SCHEMBL28821609 0.83 TSHR (0.39) TSHRALDH1A1TP53CYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5028638-A Hybrid plastic filling material BAYER AKTIENGESELLSCHAFT (DE) 1991-07-02 US claimed
CN-115605529-B Photochromic polydiorganosiloxane vinyl cross-linking agent 爱尔康公司 2024-03-26 CN disclosed
CN-117546077-A Contact lens and method for manufacturing the same 日油株式会社 2024-02-09 CN disclosed
CN-116867836-A Hydrophilized polydiorganosiloxane vinyl cross-linking agent 爱尔康公司 2023-10-10 CN disclosed
CN-115605529-A Photochromic polydiorganosiloxane ethylene crosslinkers 爱尔康公司(CH) 2023-01-13 CN disclosed
CN-110621483-B Silicone hydrogel contact lenses 爱尔康公司 2021-10-29 CN disclosed
CN-113480736-A Hydrophilized polydiorganosiloxane vinyl crosslinkers and uses thereof 爱尔康公司 2021-10-08 CN disclosed
CN-108473681-B Hydrophilized polydiorganosiloxane vinyl crosslinkers and uses thereof 爱尔康公司 2021-07-20 CN disclosed
CN-110621483-A Silicone hydrogel contact lenses 爱尔康公司 2019-12-27 CN disclosed