SCHEMBL10065880

SCHEMBL10065880

C=CC(=O)OCC(CC)CCC(C)O

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.69
HPGD P15428 1/20 0.41
CYP3A4 P08684 5/20 0.39
TDP1 Q9NUW8 2/20 0.39
ATM Q13315 1/20 0.39
ALDH1A1 P00352 7/20 0.37
TP53 P04637 3/20 0.37
HIF1A Q16665 3/20 0.37
MAPK1 P28482 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 2/20 0.36
THRB P10828 1/20 0.35
CA2 P00918 1/20 0.35
RECQL P46063 1/20 0.33
MAPT P10636 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
LMNA P02545 2/20 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
SCHEMBL21237772 0.87 TSHR (0.69) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL5887492 0.84 TSHR (0.81) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL74390 0.84 TSHR (0.73) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL11545972 0.83 TSHR (0.73) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL3453557 0.81 TSHR (0.61) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL14869 0.81 TSHR (1.00) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL16765797 0.81 TSHR (1.00) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL29596375 0.81 TSHR (1.00) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL20609794 0.81 TSHR (1.00) TSHRHPGDCYP3A4TDP1ATM
SCHEMBL28265201 0.81 TSHR (0.66) TSHRHPGDCYP3A4TDP1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120024572-A1 CONDUCTIVE COMPOSITION, TRANSPARENT CONDUCTOR USING THE SAME, AND TOUCH PANEL CONTAINING THE TRANSPARENT CONDUCTOR FUJIFILM CORPORATION (JP) 2012-02-02 US disclosed
EP-2128132-A1 OXIME ESTER COMPOUND AND PHOTOPOLYMERIZATION INITIATOR COMPRISING THE COMPOUND Adeka Corporation (JP) 2009-12-02 EP disclosed
EP-2072500-A1 OXIME ESTER COMPOUND AND PHOTOPOLYMERIZATION INITIATOR CONTAINING THE COMPOUND Adeka Corporation (JP) 2009-06-24 EP disclosed