SCHEMBL28004690

SCHEMBL28004690

CCOC(=O)C(C)(C)C(=O)OC1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.43
CYP19A1 P11511 1/20 0.42
NAAA Q02083 2/20 0.41
CHRM3 P20309 3/20 0.37
HTT P42858 1/20 0.36
ALDH1A1 P00352 1/20 0.36
FKBP1A P62942 2/20 0.35
CYP4F2 P78329 2/20 0.35
CYP4A11 Q02928 2/20 0.35
THRB P10828 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
APOBEC3A P31941 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP2C19 P33261 1/20 0.34

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
SCHEMBL28004195 0.81 EPHX1 (0.42) EPHX1CYP19A1NAAAHTTALDH1A1
SCHEMBL28004242 0.78 KMT2A (0.44) EPHX1CYP19A1NAAAHTTALDH1A1
SCHEMBL28004681 0.78 EPHX1 (0.40) EPHX1CYP19A1NAAAHTTALDH1A1
SCHEMBL1562023 0.78 ALDH1A1 (0.50) HTTALDH1A1CYP4F2CYP4A11THRB
SCHEMBL28004198 0.78 CYP19A1 (0.47) EPHX1CYP19A1NAAACHRM3HTT
SCHEMBL26939572 0.77 CYP19A1 (0.46) EPHX1CYP19A1NAAACHRM3HTT
SCHEMBL7899893 0.76 EPHX1 (0.44) EPHX1CYP19A1NAAACHRM3HTT
SCHEMBL2597456 0.76 DGAT1 (0.48) EPHX1CYP19A1NAAACHRM3HTT
Hydrochloric Acid SCHEMBL5446995 0.76 ALDH1A1 (0.48) HTTALDH1A1CYP4F2CYP4A11THRB
SCHEMBL28014931 0.76 NAAA (0.46) EPHX1CYP19A1NAAAHTTALDH1A1

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