SCHEMBL8064983

SCHEMBL8064983

C=CC(=O)OCCCOC(C)CC(C)C

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.55
ALDH1A1 P00352 4/20 0.55
CYP3A4 P08684 2/20 0.55
HPGD P15428 1/20 0.55
TP53 P04637 3/20 0.46
HIF1A Q16665 3/20 0.46
HSD17B10 Q99714 1/20 0.46
THRB P10828 2/20 0.39
ATM Q13315 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HCAR2 Q8TDS4 3/20 0.33
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 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
SCHEMBL27942529 0.84 TSHR (0.61) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL11920491 0.83 TSHR (0.60) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL27603516 0.82 TSHR (0.64) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL9627938 0.81 TSHR (0.49) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL24282492 0.80 TSHR (0.67) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL2608225 0.80 TSHR (0.67) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL29575712 0.79 TSHR (0.47) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL13346682 0.79 TSHR (0.64) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL321925 0.79 TSHR (0.85) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL2608235 0.79 TSHR (0.70) TSHRALDH1A1CYP3A4HPGDTP53

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-6040009-A SOLVENTS, POLYESTER RESIN, STAR OLIGOMER AND CURING AGENTS MAZDA MOTOR CORPORATION (JP) 2000-03-21 US disclosed
EP-0688841-A2 Low solvent content type-resin composition, coating composition containing such resin composition and process for coating such coating composition MAZDA MOTOR CORPORATION (JP) 1995-12-27 EP disclosed