SCHEMBL21629403

SCHEMBL21629403

C=CC(=O)OC(C=C)(COCC)OCC

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.38
ALDH1A1 P00352 4/20 0.37
TP53 P04637 3/20 0.37
HIF1A Q16665 3/20 0.37
CYP3A4 P08684 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TSHR P16473 6/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL8731568 0.79 THRB (0.40) THRBALDH1A1TP53HIF1ACYP3A4
SCHEMBL11803748 0.78 THRB (0.39) THRBALDH1A1TP53HIF1ACYP3A4
SCHEMBL9154830 0.77 THRB (0.41) THRBALDH1A1TP53HIF1ACYP3A4
SCHEMBL8731766 0.76
SCHEMBL14776896 0.75 THRB (0.37) THRBALDH1A1TP53HIF1ACYP3A4
SCHEMBL25678437 0.75 ALDH1A1 (0.60) THRBALDH1A1TP53HIF1ACYP3A4
SCHEMBL14509342 0.75 THRB (0.42) THRBALDH1A1TP53HIF1ACYP3A4
SCHEMBL1898814 0.74 TSHR (0.39) THRBALDH1A1TP53HIF1ACYP3A4
SCHEMBL11227914 0.74 THRB (0.36) THRBALDH1A1TP53HIF1ACYP3A4
SCHEMBL554711 0.74 THRB (0.41) THRBALDH1A1TP53HIF1ACYP3A4

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-11208516-B2 Composition, cured product, storage container, image forming apparatus, and image forming method RICOH COMPANY, LTD. (JP) 2021-12-28 US disclosed
US-20200031969-A1 COMPOSITION, CURED PRODUCT, STORAGE CONTAINER, IMAGE FORMING APPARATUS, AND IMAGE FORMING METHOD RICOH COMPANY, LTD. (JP) 2020-01-30 US disclosed