SCHEMBL10885382

SCHEMBL10885382

C=C(C)C(=O)OCC.C=C(C)C(=O)OCCCC.C=C(CC=C(C)C(=O)O)C(=O)OCCO

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.47
THRB P10828 1/20 0.38
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
HCAR2 Q8TDS4 1/20 0.32
ATM Q13315 1/20 0.32
ACHE P22303 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
SCHEMBL7253549 0.96 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL8636772 0.96 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL1179097 0.92 TSHR (0.46) TSHRTHRBPOLBAPEX1HTT
SCHEMBL11236476 0.92 TSHR (0.58) TSHRTHRBPOLBAPEX1HTT
SCHEMBL6680853 0.91 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL8430254 0.91 TSHR (0.55) TSHRTHRBPOLBAPEX1HTT
SCHEMBL8425837 0.91 TSHR (0.55) TSHRTHRBPOLBAPEX1HTT
SCHEMBL4606541 0.91 TSHR (0.47) TSHRTHRBPOLBAPEX1HTT
SCHEMBL3670738 0.87 TSHR (0.47) TSHRTHRBPOLBAPEX1HTT
SCHEMBL10482342 0.86 TSHR (0.52) TSHRTHRBPOLBAPEX1HTT

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-4604139-A Dual color ink composition SAKURA COLOR PRODUCTS CORP. (JP) 1986-08-05 US disclosed
US-4545819-A Writing implement containing dual color ink composition Sakupa Color Products Corp. (JP) 1985-10-08 US disclosed
US-4490177-A Dual color ink composition SAKURA COLOR PRODUCTS CORP. (JP) 1984-12-25 US disclosed