SCHEMBL4534465

SCHEMBL4534465

Cc1ccc(O[Ti])c(C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
CA2 P00918 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ACHE P22303 1/20 0.40
POLB P06746 1/20 0.40
TYR P14679 1/20 0.40
USP2 O75604 1/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CYP3A4 P08684 2/20 0.36
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 2/20 0.35
SYK P43405 1/20 0.35
TSHR P16473 1/20 0.34
TP53 P04637 2/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
PTGS1 P23219 1/20 0.34
PTGS2 P35354 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
Hydrochloric Acid SCHEMBL4509694 0.98 ALDH1A1 (0.39) ALDH1A1CA2SMN1; SMN2ACHEPOLB
SCHEMBL3668976 0.81 ALDH1A1 (0.41) ALDH1A1CA2SMN1; SMN2ACHEPOLB
SCHEMBL1038127 0.81 ACHE (0.58) ALDH1A1CA2SMN1; SMN2ACHEPOLB
SCHEMBL29367415 0.78 ALDH1A1 (0.39) ALDH1A1CA2SMN1; SMN2ACHEPOLB
SCHEMBL15349624 0.78 USP2 (0.47) ALDH1A1CA2SMN1; SMN2ACHEPOLB
SCHEMBL132991 0.78 ALDH1A1 (0.39) ALDH1A1CA2SMN1; SMN2ACHEPOLB
Hydrochloric Acid SCHEMBL4509700 0.78 ALDH1A1 (0.39) ALDH1A1CA2SMN1; SMN2ACHEPOLB
Hydrochloric Acid SCHEMBL27843998 0.78 ALDH1A1 (0.39) ALDH1A1CA2SMN1; SMN2ACHEPOLB
SCHEMBL9496158 0.78 ALDH1A1 (0.39) ALDH1A1CA2SMN1; SMN2ACHEPOLB
Hydrochloric Acid SCHEMBL27601230 0.77 KMT2A (0.38) ALDH1A1CA2SMN1; SMN2ACHEPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104011083-B Use the polymerization of the particle containing surfactant 住友化学株式会社 2016-12-21 CN disclosed
CN-104011083-A Polymerization method using surfactant-containing particle SUMITOMO CHEMICAL CO 2014-08-27 CN disclosed
WO-2013047891-A2 WASHING METHOD, ADDITION POLYMERIZATION METHOD, PREPOLYMERIZATION METHOD, PREPOLYMERIZED CATALYTIC COMPONENT FOR ADDITION POLYMERIZATION, AND METHOD FOR PRODUCING ADDITION POLYMER USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-04-04 WO disclosed
CN-102585051-A Process for producing catalyst component for addition polymerization SUMITOMO CHEMICAL CO 2012-07-18 CN disclosed
WO-2012063972-A1 METHOD FOR COATING REACTOR SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-05-18 WO disclosed
CN-102382130-A Process for producing catalyst component for addition polymerization SUMITOMO CHEMICAL CO 2012-03-21 CN disclosed
CN-101248103-B Homopolymer and copolymer, and production process thereof SUMITOMO CHEMICAL CO 2011-04-13 CN disclosed
CN-1721458-A Process for producing catalyst component for addition polymerization, and addition polymer SUMITOMO CHEMICAL CO (JP) 2006-01-18 CN disclosed
CN-1151409-A Olefin polymerizationc atalyst component, olefin polymerizationc atalyst and producing olefin polymer SUMITOMO CHEMICAL CO (JP) 1997-06-11 CN disclosed