SCHEMBL4138048

SCHEMBL4138048

C=CC(=O)OC(C)(C)OOC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.35
TDP1 Q9NUW8 2/20 0.35
THRB P10828 1/20 0.34
ALDH1A1 P00352 7/20 0.32
TP53 P04637 3/20 0.32
HIF1A Q16665 3/20 0.32
CYP3A4 P08684 2/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 2/20 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
SCHEMBL8965554 0.84 TSHR (0.39) TSHRTHRBALDH1A1TP53HIF1A
SCHEMBL1116587 0.82 TSHR (0.38) TSHRTDP1ALDH1A1HSD17B10
SCHEMBL30658 0.79
SCHEMBL28051179 0.79 TSHR (0.39) TSHRTHRBALDH1A1TP53HIF1A
SCHEMBL10350318 0.77
SCHEMBL9862049 0.77 TSHR (0.35) TSHRTHRBALDH1A1TP53HIF1A
SCHEMBL9862055 0.77 TSHR (0.35) TSHRTHRBALDH1A1TP53HIF1A
SCHEMBL11333311 0.77 HCAR2 (0.36) TSHRTHRBALDH1A1TP53HIF1A
SCHEMBL1068177 0.77 TSHR (0.35) TSHRTHRBALDH1A1TP53HIF1A
SCHEMBL44413 0.77 TSHR (0.42) TSHRTDP1ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8208967-A None JP disclosed
US-20090130419-A1 FOAM SHEET AND PRODUCTION PROCESS THEREOF OJI PAPER CO., LTD (JP) 2009-05-21 US disclosed
US-20060210785-A1 Foamed product in a sheet form and method for production thereof OJI PAPER CO., LTD. (JP) 2006-09-21 US disclosed
EP-1647570-A1 FOAMED PRODUCT IN A SHEET FORM AND METHOD FOR PRODUCTION THEREOF Oji Paper Co., Ltd. (JP) 2006-04-19 EP disclosed
JP-H08208967-A UNSATURATED POLYESTER RESIN COMPOSITION SUMITOMO BAKELITE CO LTD 1996-08-13 JP disclosed