SCHEMBL11058201

SCHEMBL11058201

C=CC(=O)OCCC([Na])S(=O)(=O)O

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.47
ALDH1A1 P00352 4/20 0.47
TP53 P04637 3/20 0.47
HIF1A Q16665 3/20 0.47
CYP3A4 P08684 2/20 0.47
HSD17B10 Q99714 1/20 0.47
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
THRB P10828 2/20 0.37

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
SCHEMBL6231220 0.81 TSHR (0.50) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL9644968 0.81 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL9994805 0.80 TSHR (0.48) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL5052638 0.79 TSHR (0.48) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL10702026 0.77 TSHR (0.47) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL11702931 0.77 TSHR (0.46) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL5052502 0.75 TSHR (0.51) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL4776174 0.73 TSHR (0.50) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL6368712 0.72 TSHR (0.58) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL10337184 0.72 TSHR (0.58) 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
EP-0120167-A1 Electrically activatable recording element and process EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1984-10-03 EP disclosed
US-4435490-A GROUP VIII B OR I B METAL COMPLEX, IONIC POLYMER EASTMAN KODAK COMPANY (US) 1984-03-06 US disclosed