SCHEMBL4628635

SCHEMBL4628635

CCOC(=O)c1cc(Br)c(Cl)c(C(C)(C)C)c1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
MAOB P27338 1/20 0.40
CA1 P00915 4/20 0.40
CA2 P00918 4/20 0.40
CA12 O43570 3/20 0.40
CA9 Q16790 3/20 0.40
MAPK1 P28482 2/20 0.39
TSHR P16473 3/20 0.38
HSD17B10 Q99714 1/20 0.38
KDM4E B2RXH2 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
BAZ2B Q9UIF8 1/20 0.37
BAZ2A Q9UIF9 1/20 0.37
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CA7 P43166 2/20 0.35
CA14 Q9ULX7 2/20 0.35
GPR35 Q9HC97 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
SCHEMBL4628353 0.88 ESR1 (0.44) MAPK1TSHRHSD17B10ALDH1A1
SCHEMBL4627406 0.86 CA1 (0.40) CYP4F2CYP4A11CA1CA2CA12
SCHEMBL4628624 0.86 MAPK1 (0.40) CYP4F2CYP4A11MAOBCA1CA2
SCHEMBL4627101 0.85 MAPK1 (0.39) CYP4F2CYP4A11CA1CA2CA12
SCHEMBL4625610 0.84 MAPK1 (0.39) CYP4F2CYP4A11MAOBCA1CA2
SCHEMBL4626624 0.82 MAOB (0.39) CYP4F2CYP4A11MAOBCA1CA2
SCHEMBL4627086 0.81 MAPK1 (0.40) CYP4F2CYP4A11CA1CA2CA12
SCHEMBL4628602 0.81 CYP4F2 (0.42) CYP4F2CYP4A11CA1CA2CA12
SCHEMBL4628622 0.80 MAPK1 (0.39) CYP4F2CYP4A11CA1CA2CA12
SCHEMBL6911128 0.80 TSHR (0.44) CYP4F2CYP4A11CA1CA2CA12

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