SCHEMBL3230002

SCHEMBL3230002

O=C(OCCCOCc1ccccc1)OCCCOCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.52
TSHR P16473 2/20 0.50
ALDH1A1 P00352 5/20 0.48
L3MBTL1 Q9Y468 4/20 0.47
TDP1 Q9NUW8 4/20 0.47
MAPK1 P28482 2/20 0.47
CYP3A4 P08684 1/20 0.47
LMNA P02545 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
KMT2A Q03164 1/20 0.47
TEAD3 Q99594 1/20 0.47
HTT P42858 1/20 0.46
EPHX2 P34913 1/20 0.45

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
SCHEMBL1844409 0.92 NAAA (0.47) NAAATSHRALDH1A1L3MBTL1TDP1
SCHEMBL6945037 0.92 NAAA (0.47) NAAATSHRALDH1A1L3MBTL1TDP1
SCHEMBL3230007 0.89 NAAA (0.52) NAAATSHRALDH1A1L3MBTL1TDP1
SCHEMBL8506264 0.89 TSHR (0.54) NAAATSHRALDH1A1L3MBTL1TDP1
SCHEMBL3543222 0.87 LMNA (0.53) NAAATSHRALDH1A1L3MBTL1TDP1
SCHEMBL26648126 0.86 ALDH1A1 (0.50) NAAATSHRALDH1A1L3MBTL1TDP1
SCHEMBL18661335 0.86 LMNA (0.67) NAAATSHRALDH1A1L3MBTL1TDP1
SCHEMBL28934013 0.86 ALDH1A1 (0.65) NAAATSHRALDH1A1L3MBTL1TDP1
SCHEMBL9709561 0.84 NAAA (0.49) NAAATSHRALDH1A1L3MBTL1TDP1
SCHEMBL8621469 0.84 TSHR (0.70) NAAATSHRL3MBTL1TDP1TEAD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023145153-A1 SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION AND PRODUCTION METHOD THEREFOR, METHOD FOR PRODUCING CATALYST FOR OLEFIN POLYMERIZATION, AND METHOD FOR PRODUCING OLEFIN POLYMER 東邦チタニウム株式会社 2023-08-03 WO disclosed
EP-2759552-B1 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFIN, CATALYST FOR POLYMERIZATION OF OLEFIN, AND METHOD FOR PRODUCING OLEFIN POLYMER TOHO TITANIUM CO LTD (JP) 2016-02-10 EP disclosed
US-9243081-B2 Solid catalyst component for polymerization of olefin, catalyst for polymerization of olefin, and method for producing olefin polymer TOHO TITANIUM CO., LTD. (JP) 2016-01-26 US disclosed
US-20140343237-A1 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFIN, CATALYST FOR POLYMERIZATION OF OLEFIN, AND METHOD FOR PRODUCING OLEFIN POLYMER TOHO TITANIUM CO., LTD. (JP) 2014-11-20 US disclosed
EP-2759552-A1 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFIN, CATALYST FOR POLYMERIZATION OF OLEFIN, AND METHOD FOR PRODUCING OLEFIN POLYMER Toho Titanium CO., LTD. (JP) 2014-07-30 EP disclosed
WO-2010011814-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2010-01-28 WO disclosed