SCHEMBL5485731

SCHEMBL5485731

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

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.39
HPGD P15428 1/20 0.38
ALDH1A1 P00352 5/20 0.33
TP53 P04637 3/20 0.33
HIF1A Q16665 3/20 0.33
CYP3A4 P08684 2/20 0.33
HSD17B10 Q99714 1/20 0.33
THRB P10828 3/20 0.33
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL28490122 0.86 TSHR (0.38) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL6274690 0.80 TSHR (0.49) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL277923 0.80 TSHR (0.39) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL4563557 0.80 TSHR (0.35) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL11252991 0.80 TSHR (0.35) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL692578 0.78 TSHR (0.38) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL27991172 0.78 TSHR (0.35) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL27494684 0.78 TSHR (0.41) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL147629 0.78 TSHR (0.45) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL18427851 0.77 THRB (0.39) TSHRALDH1A1THRB

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
US-20070060994-A1 Blood flow diverters for the treatment of intracranial aneurysms GOBRAN RIAD H 2007-03-15 US claimed
US-20050283220-A1 Blood flow diverters for the treatment of intracranial aneurysms GOBRAN RIAD H 2005-12-22 US claimed
JP-60168712-A None JP disclosed
US-5250645-A Methoxypolyalkoxyethyl methacrylate or acrylate, an initiator, polymerization accelerator and water RHONE-POULENC CHIMIE (FR) 1993-10-05 US disclosed
JP-S60168712-A AQUEOUS TWO-LAYER POLYMER EMULSION AND ITS PRODUCTION NITTO ELECTRIC IND CO LTD 1985-09-02 JP disclosed