SCHEMBL10705649

SCHEMBL10705649

CC=C(C)C(=O)OCCOCC(CC)CCCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.49
TSHR P16473 3/20 0.49
MMP9 P14780 1/20 0.48
MMP8 P22894 1/20 0.48
MMP14 P50281 1/20 0.48
TDP1 Q9NUW8 2/20 0.48
ATM Q13315 1/20 0.48
ALDH1A1 P00352 6/20 0.43
CA2 P00918 3/20 0.43
RECQL P46063 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 3/20 0.39
MAPK1 P28482 2/20 0.39
HSD17B10 Q99714 1/20 0.39
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
NCOA1 Q15788 1/20 0.38
NCOA3 Q9Y6Q9 1/20 0.38
PLA2G2C Q5R387 1/20 0.38

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
SCHEMBL4239989 0.86 TSHR (0.59) CYP3A4TSHRMMP9MMP8MMP14
SCHEMBL1982685 0.84 THRB (0.54) CYP3A4TSHRMMP9MMP8MMP14
SCHEMBL17091387 0.83 CYP3A4 (0.56) CYP3A4TSHRMMP9MMP8MMP14
SCHEMBL26920606 0.83 THRB (0.53) CYP3A4TSHRMMP9MMP8MMP14
SCHEMBL985292 0.83 THRB (0.53) CYP3A4TSHRMMP9MMP8MMP14
SCHEMBL5452606 0.79 TSHR (0.43) CYP3A4TSHRMMP9MMP8MMP14
SCHEMBL546262 0.79 TSHR (0.43) CYP3A4TSHRMMP9MMP8MMP14
SCHEMBL9090344 0.79 CYP3A4 (0.58) CYP3A4TSHRMMP9MMP8MMP14
SCHEMBL22186939 0.78 TSHR (0.54) CYP3A4TSHRMMP9MMP8MMP14
SCHEMBL29109726 0.78 TSHR (0.54) CYP3A4TSHRMMP9MMP8MMP14

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
EP-0105639-B1 PRODUCTION OF RESISTOR FROM INSULATING MATERIAL BY LOCAL HEATING KABUSHIKI KAISHA TOSHIBA (JP) 1988-01-07 EP disclosed
US-4584456-A Production of resistor from insulating material by local heating TOKYO SHIBAURA DENKI KABUSHIKI KAISHA (JP) 1986-04-22 US disclosed
EP-0105639-A2 Production of resistor from insulating material by local heating KABUSHIKI KAISHA TOSHIBA (JP) 1984-04-18 EP disclosed