SCHEMBL28068530

SCHEMBL28068530

C=C(C)C(=O)OP(=O)(OCCO)OP(=O)(O)O

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 3/20 0.40
THRB P10828 1/20 0.32
ALDH1A1 P00352 2/20 0.31
TSHR P16473 3/20 0.31
PPARD Q03181 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
SCHEMBL28193503 0.88 ALDH1A1 (0.37) BTN3A1THRBALDH1A1TSHR
SCHEMBL28200633 0.82 THRB (0.40) THRBALDH1A1TSHRPPARD
SCHEMBL27511878 0.80 TSHR (0.40) BTN3A1THRBALDH1A1TSHR
SCHEMBL1300485 0.80 BTN3A1 (0.41) BTN3A1THRBALDH1A1TSHRPPARD
SCHEMBL28292301 0.79 CYP3A4 (0.48) THRBALDH1A1TSHR
SCHEMBL25398870 0.78 SMN1; SMN2 (0.39) THRBTSHR
SCHEMBL19833987 0.78 TSHR (0.35) THRBTSHR
SCHEMBL345559 0.77 THRB (0.49) BTN3A1THRBALDH1A1TSHR
SCHEMBL28920067 0.77 BTN3A1 (0.46) BTN3A1PPARD
Pyrophosphoric Acid SCHEMBL4975674 0.76 THRB (0.47) BTN3A1THRBALDH1A1TSHRPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111886239-A Bismuth compound, curable composition, and cured product 株式会社德山 2020-11-03 CN disclosed
CN-109906210-A Additive for architectural chemistry composition 巴斯夫欧洲公司 2019-06-18 CN disclosed
CN-105934417-B Calcium sulfate composition comprising an additive 巴斯夫欧洲公司 2019-03-29 CN disclosed
CN-105934418-B Additive for hydraulic-composition 建筑研究和技术有限公司 2019-02-19 CN disclosed
CN-104955784-B Hardening accelerator composition 巴斯夫欧洲公司 2018-01-05 CN disclosed
CN-107531568-A Method for producing a hardening accelerator comprising calcium silicate hydrate in powder form 巴斯夫欧洲公司 2018-01-02 CN disclosed
CN-105377790-B Additive for hydraulically setting compounds 建筑研究和技术有限公司 2017-07-14 CN disclosed
CN-104661981-B Additive for hydraulic-composition 建筑研究和技术有限公司 2016-11-09 CN disclosed
CN-105934417-A Calcium sulfate composition comprising an additive 巴斯夫欧洲公司 2016-09-07 CN disclosed
CN-105934418-A Additive for hydraulically setting compositions 建筑研究和技术有限公司 2016-09-07 CN disclosed