SCHEMBL7048814

SCHEMBL7048814

CCc1cc(C(C)(C)c2cc(CC)c(OCCO)c(CC)c2)cc(CC)c1OCCO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.37
KLF10 Q13118 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
CYP3A4 P08684 3/20 0.37
HSD17B10 Q99714 3/20 0.37
KMT2A Q03164 3/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GAA P10253 1/20 0.37
LMNA P02545 2/20 0.35
USP2 O75604 1/20 0.35
ESR1 P03372 3/20 0.33
ESR2 Q92731 3/20 0.33
S1PR1 P21453 1/20 0.33
NR1I2 O75469 1/20 0.33
ALDH1A1 P00352 3/20 0.32
MEN1 O00255 2/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
MCHR1 Q99705 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
SCHEMBL7912734 0.84 ESR1 (0.47) CYP3A4HSD17B10KMT2ASMN1; SMN2GAA
SCHEMBL7907559 0.83 CYP3A4 (0.33) CYP3A4HSD17B10KMT2ASMN1; SMN2GAA
SCHEMBL7047684 0.82 MEN1 (0.38) ALOX15MAPK1HTTCYP3A4KMT2A
SCHEMBL7907575 0.81 HSD17B10 (0.34) CYP3A4HSD17B10KMT2ASMN1; SMN2GAA
SCHEMBL5504504 0.81 MCHR1 (0.40) CYP3A4HSD17B10KMT2ASMN1; SMN2GAA
SCHEMBL7899686 0.81 CYP3A4 (0.32) CYP3A4HSD17B10KMT2ASMN1; SMN2GAA
SCHEMBL347042 0.79 HTR1A (0.43) ALOX15CYP3A4HSD17B10KMT2ASMN1; SMN2
SCHEMBL16688419 0.77 CYP3A4 (0.50) ALOX15MAPK1CYP3A4HSD17B10KMT2A
SCHEMBL7906090 0.77 GAA (0.31) HSD17B10KMT2AGAA
SCHEMBL7907594 0.77 S1PR1 (0.31) HSD17B10KMT2AGAAS1PR1

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
EP-0751183-B1 Thermo-shrinkable polyester films TOYO BOSEKI (JP) 2003-04-09 EP disclosed
EP-0271928-B1 Thermo-shrinkable polyester film TOYO BOSEKI (JP) 1997-04-16 EP disclosed
EP-0751183-A2 A polyester composition used for thermoshrinkable films Toyo Boseki Kabushiki Kaisha (JP) 1997-01-02 EP disclosed
US-4996291-A Wrapping material TOYO BOSEKI KABUSHIKI KAISHA (JP) 1991-02-26 US disclosed