SCHEMBL26969552

SCHEMBL26969552

C=C(C)C(=O)OCCC[Si](OC)(OC)OC.C=CC(=O)OCCN(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.40
HPGD P15428 1/20 0.40
ALDH1A1 P00352 4/20 0.40
CYP3A4 P08684 1/20 0.40
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TP53 P04637 2/20 0.33
HIF1A Q16665 2/20 0.33
THRB P10828 2/20 0.33
HSD17B10 Q99714 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRM3 P20309 1/20 0.33
CHRNA4 P43681 1/20 0.33
POLB P06746 1/20 0.32
APEX1 P27695 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
SCHEMBL28122034 0.91 TSHR (0.45) TSHRALDH1A1LMNASMN1; SMN2THRB
SCHEMBL5448469 0.91 TSHR (0.47) TSHRHPGDALDH1A1CYP3A4SMN1; SMN2
SCHEMBL5971626 0.86 TSHR (0.58) TSHRHPGDALDH1A1CYP3A4LMNA
SCHEMBL28246671 0.86 TSHR (0.43) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL1538397 0.85 TSHR (0.44) TSHRHPGDALDH1A1CYP3A4SMN1; SMN2
SCHEMBL28313944 0.85 TSHR (0.42) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL4434827 0.85 TSHR (0.44) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL14993100 0.85 TSHR (0.42) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL23120125 0.84 TSHR (0.46) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL424597 0.84 TSHR (0.44) TSHRHPGDALDH1A1CYP3A4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230416557-A1 ANTIFOG COMPOSITIONS AND ARTICLES MADE THEREOF Kraton Corporation (US) 2023-12-28 US disclosed