SCHEMBL29323667

SCHEMBL29323667

C=CC(=O)OCCS(=O)(=O)CC1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.41
ALDH1A1 P00352 4/20 0.41
TP53 P04637 3/20 0.41
HIF1A Q16665 3/20 0.41
CYP3A4 P08684 2/20 0.41
HSD17B10 Q99714 1/20 0.41
HPGD P15428 1/20 0.38
THRB P10828 2/20 0.33
LMNA P02545 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
EPHX1 P07099 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
SCHEMBL29323714 0.78 THRB (0.39) TSHRALDH1A1THRBLMNASMN1; SMN2
SCHEMBL29323670 0.78 TSHR (0.46) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL26935991 0.77 TSHR (0.48) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL2316985 0.77 TSHR (0.48) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL17067672 0.76 TSHR (0.56) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL20573546 0.75 TSHR (0.50) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL10894893 0.74 TSHR (0.55) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL465490 0.73 LMNA (0.50) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL8408217 0.73 LMNA (0.50) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL17159421 0.73 LMNA (0.50) TSHRALDH1A1TP53HIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240241440-A1 POLYMER, PHOTORESIST COMPOSITIONS INCLUDING THE SAME, AND PATTERN FORMATION METHODS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2024-07-18 US disclosed
US-20240241440-A1 POLYMER, PHOTORESIST COMPOSITIONS INCLUDING THE SAME, AND PATTERN FORMATION METHODS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2024-07-18 US disclosed