SCHEMBL7797028

SCHEMBL7797028

CCCCC(CC)CO[Si](OCC(CC)CCCC)OCC(CC)CCCC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
TSHR P16473 4/20 0.48
TDP1 Q9NUW8 3/20 0.48
ATM Q13315 1/20 0.48
ALDH1A1 P00352 7/20 0.48
CA2 P00918 3/20 0.42
RECQL P46063 1/20 0.40
LMNA P02545 2/20 0.38
MMP9 P14780 1/20 0.38
MMP8 P22894 1/20 0.38
MMP14 P50281 1/20 0.38
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
CHRM2 P08172 1/20 0.33
HTR1A P08908 1/20 0.33
ADRA2A P08913 1/20 0.33

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
SCHEMBL9764741 0.83 CYP3A4 (0.55) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL9764744 0.79 CYP3A4 (0.52) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL5198521 0.78 CYP3A4 (0.59) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL80432 0.78 CYP3A4 (0.67) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL4813584 0.78 CYP3A4 (0.50) CYP3A4L3MBTL1TSHRTDP1ATM
Lithium Ion SCHEMBL4881905 0.78 CYP3A4 (0.50) CYP3A4L3MBTL1TSHRTDP1ATM
Potassium Ion SCHEMBL4810082 0.78 CYP3A4 (0.50) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL4812744 0.78 CYP3A4 (0.50) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL4804294 0.78 CYP3A4 (0.50) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL31397815 0.77 CYP3A4 (0.53) CYP3A4L3MBTL1TSHRTDP1ATM

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-0743347-B1 Water-based fluorine-containing paint CENTRAL GLASS CO LTD (JP) 2001-12-05 EP disclosed
US-5856394-A TETRAPOLYMERS OF FLUOROOLEFIN, VINYL ETHER OR ESTER, OMEGA-UNSATURATED ALKENOIC ACID, ALLYL ACETOACETATE OR ALKYLENE OXIDE DERIVATIVE, HYDRAZINE HARDENER CENTRAL GLASS COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0743347-A2 Water-based fluorine-containing paint CENTRAL GLASS COMPANY, LIMITED (JP) 1996-11-20 EP disclosed