SCHEMBL31055374

SCHEMBL31055374

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

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.56
ALDH1A1 P00352 4/20 0.56
CYP3A4 P08684 2/20 0.56
HPGD P15428 1/20 0.51
TP53 P04637 3/20 0.43
HIF1A Q16665 3/20 0.43
HSD17B10 Q99714 1/20 0.43
THRB P10828 2/20 0.37
HCAR2 Q8TDS4 3/20 0.37
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ATM Q13315 1/20 0.34

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
SCHEMBL1469631 0.80 TSHR (0.60) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL7759302 0.80 TSHR (0.60) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL4596157 0.79 TSHR (0.69) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL30450231 0.79 TSHR (0.63) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL30450181 0.79 TSHR (0.63) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL5835079 0.78 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL6668032 0.77 TSHR (0.56) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL244114 0.76 TSHR (0.95) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL29004482 0.76 TSHR (0.59) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL3293446 0.75 TSHR (0.63) TSHRALDH1A1CYP3A4HPGDTP53

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-118638418-A Groove type sucker and preparation method and application thereof 中山凌晟金属制品有限公司 2024-09-13 CN claimed
CN-118638418-A Groove type sucker and preparation method and application thereof 中山凌晟金属制品有限公司 2024-09-13 CN disclosed
CN-118638418-A Groove type sucker and preparation method and application thereof 中山凌晟金属制品有限公司 2024-09-13 CN disclosed