SCHEMBL28004685

SCHEMBL28004685

CC(C)COC(=O)C(C(=O)OC1CCCC1)(C(C)C)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.36
EPHX1 P07099 2/20 0.36
CYP19A1 P11511 2/20 0.35
NAAA Q02083 2/20 0.34
HTT P42858 1/20 0.33
TSHR P16473 3/20 0.33
CACNA1B Q00975 1/20 0.31
MMP2 P08253 2/20 0.31
MMP9 P14780 2/20 0.31
ANPEP P15144 2/20 0.31
LTA4H P09960 1/20 0.31
LAP3 P28838 1/20 0.31
NPEPPS P55786 1/20 0.31
ERAP2 Q6P179 1/20 0.31
ERAP1 Q9NZ08 1/20 0.31
CYP2C19 P33261 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL28004677 0.98 EPHX1 (0.38) RAB9AEPHX1CYP19A1NAAAHTT
SCHEMBL28004681 0.86 EPHX1 (0.40) EPHX1CYP19A1NAAAHTTTSHR
SCHEMBL235813 0.81 TSHR (0.45) RAB9ATSHRL3MBTL1ALDH1A1
SCHEMBL28004684 0.79 EPHX1 (0.42) RAB9AEPHX1CYP19A1NAAAHTT
SCHEMBL6896395 0.76 EPHX1 (0.42) RAB9AEPHX1CYP19A1NAAAHTT
SCHEMBL304317 0.75 EPHX1 (0.44) RAB9AEPHX1CYP19A1NAAAHTT
SCHEMBL16732294 0.73 RAB9A (0.40) RAB9AEPHX1TSHRALDH1A1
SCHEMBL7199940 0.73 TSHR (0.44) RAB9AEPHX1CYP19A1NAAAHTT
SCHEMBL27101965 0.73 RAB9A (0.41) RAB9AEPHX1CYP19A1NAAAHTT
SCHEMBL11991229 0.73 CYP19A1 (0.47) RAB9AEPHX1CYP19A1NAAAHTT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104640886-A PRODUCTION METHOD FOR SOLID CATALYST COMPONENT FOR POLYMERIZING OLEFINS, CATALYST FOR POLYMERIZING OLEFINS, AND PRODUCTION METHOD FOR POLYMERIZED OLEFINS TOHO TITANIUM CO LTD 2015-05-20 CN disclosed
CN-104470953-A Process for producing solid catalyst component for olefin polymerization, catalyst for olefin polymerization, and process for producing olefin polymer TOHO TITANIUM CO LTD 2015-03-25 CN disclosed