SCHEMBL7939123

SCHEMBL7939123

C=C(C)C(=O)OC(CCC(CC)CCCC)CC(C)C

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.40
CA2 P00918 4/20 0.40
TSHR P16473 6/20 0.38
CYP3A4 P08684 4/20 0.37
TDP1 Q9NUW8 2/20 0.37
ATM Q13315 1/20 0.37
ALDH1A1 P00352 4/20 0.35
L3MBTL1 Q9Y468 1/20 0.33
RECQL P46063 1/20 0.32
CA1 P00915 1/20 0.31
MMP9 P14780 1/20 0.31
MMP8 P22894 1/20 0.31
MMP14 P50281 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
SCHEMBL27467824 0.88 CTSK (0.39) CTSKCA2TSHRCYP3A4TDP1
SCHEMBL29540667 0.84 TSHR (0.41) CTSKCA2TSHRCYP3A4TDP1
SCHEMBL8414633 0.83 TSHR (0.41) CTSKCA2TSHRCYP3A4TDP1
SCHEMBL11650937 0.82 CA2 (0.44) CA2TSHRCYP3A4TDP1ATM
SCHEMBL17506168 0.82 TSHR (0.44) CTSKTSHRALDH1A1
SCHEMBL29362752 0.82 TSHR (0.44) CA2TSHRCYP3A4TDP1ATM
SCHEMBL4902309 0.81 TSHR (0.55) CTSKCA2TSHRCYP3A4TDP1
SCHEMBL27697659 0.80 ALDH1A1 (0.44) CA2TSHRCYP3A4TDP1ATM
SCHEMBL11057143 0.80 TSHR (0.45) CA2TSHRCYP3A4TDP1ATM
SCHEMBL2817125 0.80 TSHR (0.42) CA2TSHRCYP3A4TDP1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6224970-B1 A FILM WHICH IS EXCELLENT IN TRANSPARENCY, SLIPPERINESS AND ANTIBLOCKING PROPERTY; CRITICAL SURFACE TENSION, ACRYLIC ESTER POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-05-01 US disclosed
US-5958574-A A UNIAXIAL ORIENTED SHEET OF A POLYOLEFIN RESIN AND BEADS OF A CROSSLINKED (METH)ACRYLIC ESTER AND DIVINYL COMPOUND; SLIPPERINESS, RADIATION TRANSPARENCY AND NONADHERING WHEN OVERLAPPING; FOOD AND FIBER PACKAGING SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-09-28 US disclosed
CN-1168906-A Polyolefin resin composition and oriented film therefrom SUMITOMO CHEMICAL CO (JP) 1997-12-31 CN disclosed
EP-0791625-A2 Polyolefin resin composition and oriented film therefrom SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-08-27 EP disclosed