SCHEMBL4625675

SCHEMBL4625675

CCOC(=O)c1cc(Cl)c(Cl)cc1C(=O)OCCCC(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
BAZ2B Q9UIF8 1/20 0.43
BAZ2A Q9UIF9 1/20 0.43
CA1 P00915 4/20 0.43
CA2 P00918 4/20 0.43
CA12 O43570 3/20 0.43
CA9 Q16790 3/20 0.43
ALOX15 P16050 3/20 0.42
ESR1 P03372 1/20 0.42
TSHR P16473 4/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
MAPK1 P28482 1/20 0.40
CA7 P43166 2/20 0.39
CA14 Q9ULX7 2/20 0.39

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
SCHEMBL233889 0.94 ESR1 (0.43) ESR1TSHRTDP1L3MBTL1KMT2A
SCHEMBL4628682 0.93 CYP4F2 (0.41) CYP4F2CYP4A11BAZ2BBAZ2ACA1
SCHEMBL4628042 0.93 CYP4F2 (0.41) CYP4F2CYP4A11BAZ2BBAZ2ACA1
SCHEMBL6912804 0.92 CYP4F2 (0.40) CYP4F2CYP4A11BAZ2BBAZ2ACA1
SCHEMBL4627190 0.92 CYP4F2 (0.40) CYP4F2CYP4A11BAZ2BBAZ2ACA1
SCHEMBL4627196 0.91 ESR1 (0.52) ESR1TSHRTDP1L3MBTL1KMT2A
SCHEMBL4628284 0.91 CYP4F2 (0.42) CYP4F2CYP4A11BAZ2BBAZ2ACA1
SCHEMBL4628595 0.88 ESR1 (0.39) ALOX15ESR1TSHRTDP1L3MBTL1
SCHEMBL4628564 0.88 KMT2A (0.48) ESR1TSHRTDP1L3MBTL1KMT2A
SCHEMBL4625761 0.88 TSHR (0.43) CA1CA2CA12CA9ALOX15

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