SCHEMBL8749381

SCHEMBL8749381

C#CCOOCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.46
IDO1 P14902 1/20 0.43
AGXT P21549 1/20 0.41
LMNA P02545 3/20 0.38
MAOB P27338 2/20 0.38
CYP3A4 P08684 2/20 0.38
NPC1 O15118 1/20 0.38
USP2 O75604 1/20 0.38
MAOA P21397 1/20 0.38
PYCR1 P32322 1/20 0.38
ALDH1A1 P00352 4/20 0.37
BLM P54132 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CYP1A2 P05177 2/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
PTGS1 P23219 1/20 0.36
SLC6A2 P23975 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL177923 0.81 TSHR (0.67) TSHRIDO1AGXTLMNAMAOB
SCHEMBL470893 0.80 TSHR (0.61) TSHRIDO1AGXTLMNANPC1
SCHEMBL19460555 0.78 TSHR (0.58) TSHRIDO1AGXTLMNAALDH1A1
SCHEMBL4363419 0.78 TSHR (0.63) TSHRIDO1AGXTLMNAMAOB
Water SCHEMBL28419682 0.78 TSHR (0.63) TSHRIDO1AGXTLMNAMAOB
SCHEMBL28091300 0.76 IDO1 (0.50) IDO1LMNAMAOBNPC1MAOA
SCHEMBL27405093 0.76 TSHR (0.60) TSHRIDO1AGXTLMNAMAOB
SCHEMBL7429874 0.75 TSHR (0.43) TSHRIDO1AGXTLMNAMAOB
SCHEMBL23567271 0.75 TSHR (0.54) TSHRIDO1AGXTLMNANPC1
SCHEMBL3821073 0.75 TSHR (0.54) TSHRIDO1AGXTLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109384934-B Double-grafted polymer with main chain containing cyclic structure and preparation method thereof 苏州大学 2021-01-29 CN claimed
CN-110678500-B Photo-or thermosetting method and curable resin composition 富士胶片和光纯药株式会社 2022-10-14 CN disclosed
CN-111848975-B Phosphorylated protein, intracellular delivery system based on phosphorylated protein, preparation method and application 苏州大学 2022-07-19 CN disclosed
CN-108602955-B Photocuring method, compound used in photocuring method, and composition 富士胶片和光纯药株式会社 2021-08-06 CN disclosed
CN-109384934-B Double-grafted polymer with main chain containing cyclic structure and preparation method thereof 苏州大学 2021-01-29 CN disclosed
CN-111848975-A Phosphorylated protein, intracellular delivery system based on phosphorylated protein, preparation method and application 苏州大学 2020-10-30 CN disclosed
CN-110678500-A Photo-or thermosetting method and curable resin composition 富士胶片和光纯药株式会社 2020-01-10 CN disclosed
EP-0488817-B1 Heterofunctional macromers and polymers derived therefrom NIPPON PAINT CO LTD (JP) 1997-03-26 EP disclosed
US-5239031-A Heterofunctional macromer compound, its preparation and polymer derived therefrom NIPPON PAINT CO., LTD. (JP) 1993-08-24 US disclosed
US-5239032-A Heterofunctional macromer compound, its preparation and polymer derived therefrom NIPPON PAINT CO., LTD. (JP) 1993-08-24 US disclosed
US-5191032-A HETEROFUNCTIONAL MACROMER COMPOUND, ITS PREPARATION AND POLYMER DERIVED THEREFROM NIPPON PAINT CO., LTD. (JP) 1993-03-02 US disclosed
EP-0488817-A2 Heterofunctional macromers and polymers derived therefrom NIPPON PAINT CO., LTD. (JP) 1992-06-03 EP disclosed