SCHEMBL28039239

SCHEMBL28039239

C=C(C)C(=O)OC(C)CSSCC(C)OC(=O)C(=C)C

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.47
ALDH1A1 P00352 2/20 0.41
THRB P10828 1/20 0.39
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33
TBXA2R P21731 1/20 0.33
GALR3 O60755 1/20 0.32
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
SMN1; SMN2 Q16637 1/20 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
SCHEMBL27580488 0.88 TSHR (0.41) TSHRALDH1A1THRB
SCHEMBL27182214 0.86 TSHR (0.42) TSHRALDH1A1THRBCHRM2CHRM4
SCHEMBL12285548 0.86 TSHR (0.42) TSHRALDH1A1THRBCHRM2CHRM4
SCHEMBL14509208 0.85 TSHR (0.39) TSHRALDH1A1THRB
SCHEMBL33467 0.84 TSHR (0.48) TSHRALDH1A1THRBCHRM2CHRM4
SCHEMBL12286019 0.83 TSHR (0.40) TSHRALDH1A1THRB
SCHEMBL28322415 0.83 TSHR (0.47) TSHRALDH1A1THRBCHRM2CHRM4
SCHEMBL27805092 0.83 TSHR (0.47) TSHRALDH1A1THRBCHRM2CHRM4
SCHEMBL28322566 0.83 TSHR (0.47) TSHRALDH1A1THRBCHRM2CHRM4
SCHEMBL2544205 0.82 TSHR (0.50) TSHRALDH1A1THRBCHRM2CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105153347-A Preparation method of monodisperse polymer hollow microspheres with glucose response UNIV TAIZHOU 2015-12-16 CN claimed
CN-105153347-B The preparation method of the monodisperse polymer tiny balloon of sugar response 台州学院 2017-07-07 CN disclosed
CN-105153347-A Preparation method of monodisperse polymer hollow microspheres with glucose response UNIV TAIZHOU 2015-12-16 CN disclosed