SCHEMBL22325533

SCHEMBL22325533

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

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM1 P11229 1/20 0.39
TBXA2R P21731 1/20 0.39
GALR3 O60755 1/20 0.38
MAPT P10636 1/20 0.38
BLM P54132 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 2/20 0.33
TRPV1 Q8NER1 1/20 0.32
ALOX15 P16050 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
SCHEMBL530219 0.80 TSHR (0.35) TSHR
SCHEMBL6724769 0.80 TSHR (0.35) TSHR
SCHEMBL523162 0.79 TSHR (0.48) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL4820046 0.79 TSHR (0.48) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL7787116 0.78 TSHR (0.33) TSHR
SCHEMBL530220 0.78 TSHR (0.33) TSHR
SCHEMBL10893076 0.77 TSHR (0.46) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL244781 0.76 TSHR (0.32) TSHR
SCHEMBL530525 0.76 LMNA (0.41) TSHRCHRM2CHRM4CHRM1MAPT
SCHEMBL6269584 0.76 TSHR (0.32) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116284721-B Silicon modified polycarbonate polyol and preparation method thereof 万华化学集团股份有限公司 2025-04-01 CN claimed
CN-115677774-B Phosphonate derivatives, process for their preparation and their use 上海医药工业研究院有限公司 2025-04-22 CN disclosed
CN-116284721-B Silicon modified polycarbonate polyol and preparation method thereof 万华化学集团股份有限公司 2025-04-01 CN disclosed
CN-116284721-A Silicon modified polycarbonate polyol and preparation method thereof 万华化学集团股份有限公司 2023-06-23 CN disclosed
CN-111918881-B Novel photocrosslinkable alginic acid derivative 持田制药株式会社 2022-08-12 CN disclosed
WO-2020162612-A1 PYRIDINE COMPOUND SUBSTITUTED BY HETEROARYL 大正製薬株式会社 2020-08-13 WO disclosed