SCHEMBL4628535

SCHEMBL4628535

CCCCOC(=O)c1cc(CC)c(Cl)c(CCCC(C)C)c1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.39
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
ESR1 P03372 4/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 4/20 0.37
CYP3A4 P08684 2/20 0.37
MAPK1 P28482 2/20 0.37
ATM Q13315 1/20 0.36
TP53 P04637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
LMNA P02545 1/20 0.35

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
SCHEMBL4628675 0.91 ALOX15 (0.37) TSHRL3MBTL1ALDH1A1MAPK1TP53
SCHEMBL4628087 0.90 TSHR (0.40) TSHRTDP1L3MBTL1ESR1MEN1
SCHEMBL4628601 0.89 ATM (0.40) TSHRTDP1L3MBTL1ESR1MEN1
SCHEMBL4627808 0.89 TSHR (0.41) TSHRTDP1L3MBTL1ESR1MEN1
SCHEMBL4628478 0.88 ESR1 (0.40) TSHRTDP1L3MBTL1ESR1MEN1
SCHEMBL4625752 0.88 TSHR (0.42) TSHRTDP1L3MBTL1ESR1MEN1
SCHEMBL4627859 0.87 KMT2A (0.41) TSHRTDP1L3MBTL1ESR1MEN1
SCHEMBL4628616 0.86 KMT2A (0.42) TSHRTDP1L3MBTL1ESR1MEN1
SCHEMBL4625732 0.84 TSHR (0.41) TSHRTDP1L3MBTL1ESR1MEN1
SCHEMBL4628544 0.83 ATM (0.41) TSHRTDP1L3MBTL1ESR1MEN1

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-1209172-B1 SOLID CATALYST COMPONENT AND CATALYST FOR OLEFIN POLYMERIZATION TOHO TITANIUM CO LTD (JP) 2008-07-02 EP disclosed
US-6770586-B2 Solid catalyst component and catalyst for olefins polymerization TOHO TITANIUM CO., LTD. (JP) 2004-08-03 US disclosed
US-20030130109-A1 Solid catalyst component and catalyst for olefins polymerization TOHO TITANIUM CO., LTD (JP) 2003-07-10 US disclosed
EP-1209172-A1 SOLID CATALYST COMPONENT AND CATALYST FOR OLEFIN POLYMERIZATION Toho Titanium Co., Ltd. (JP) 2002-05-29 EP disclosed