SCHEMBL28664314

SCHEMBL28664314

C=C(C)C(=O)O[Si](CCCCCCCCCCCC)(OC)OC

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.51
LMNA P02545 1/20 0.42
EPHX1 P07099 5/20 0.38
ALDH1A1 P00352 1/20 0.38
CES2 O00748 5/20 0.34
THRB P10828 2/20 0.34
THRA P10827 1/20 0.34
FAAH O00519 1/20 0.33
ZDHHC20 Q5W0Z9 1/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33
CES1 P23141 2/20 0.32

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
SCHEMBL3111019 0.93 TSHR (0.46) TSHRLMNAEPHX1ALDH1A1THRB
SCHEMBL2043794 0.85 ALDH1A1 (0.43) TSHRALDH1A1THRB
SCHEMBL27736499 0.84 LMNA (0.47) TSHRLMNAEPHX1CES2THRB
SCHEMBL11135210 0.84 LMNA (0.46) TSHRLMNAEPHX1ALDH1A1THRB
SCHEMBL26648800 0.83 TSHR (0.53) TSHRLMNAEPHX1ALDH1A1CES2
SCHEMBL28181961 0.83 TSHR (0.53) TSHRLMNAEPHX1ALDH1A1CES2
SCHEMBL29154618 0.83 TSHR (0.53) TSHRLMNAEPHX1ALDH1A1CES2
SCHEMBL28326691 0.83 TSHR (0.53) TSHRLMNAEPHX1ALDH1A1CES2
SCHEMBL16754226 0.83 TSHR (0.53) TSHRLMNAEPHX1ALDH1A1CES2
SCHEMBL29154616 0.83 TSHR (0.53) TSHRLMNAEPHX1ALDH1A1CES2

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
CN-113526934-B 3D printing graphene oxide reinforced cement-based material and preparation method thereof 中科峰达(黑龙江)新材料科技有限公司 2022-08-23 CN claimed
CN-113526934-A 3D printing graphene oxide reinforced cement-based material and preparation method thereof 梁英 2021-10-22 CN claimed
CN-113526934-B 3D printing graphene oxide reinforced cement-based material and preparation method thereof 中科峰达(黑龙江)新材料科技有限公司 2022-08-23 CN disclosed
CN-113526934-A 3D printing graphene oxide reinforced cement-based material and preparation method thereof 梁英 2021-10-22 CN disclosed