SCHEMBL1276102

SCHEMBL1276102

Cc1cc(C)cc([B-](c2cc(C)cc(C)c2)(c2ccccc2O)c2ccccc2O)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.36
TDP1 Q9NUW8 4/20 0.35
MAPT P10636 3/20 0.35
HPGD P15428 3/20 0.35
POLB P06746 2/20 0.35
KDM4E B2RXH2 2/20 0.35
CYP3A4 P08684 2/20 0.35
RECQL P46063 2/20 0.35
LMNA P02545 2/20 0.35
HSD17B10 Q99714 2/20 0.35
ALOX15 P16050 2/20 0.35
NPC1 O15118 1/20 0.35
CA12 O43570 1/20 0.35
GMNN O75496 1/20 0.35
EGFR P00533 1/20 0.35
CA2 P00918 1/20 0.35
FYN P06241 1/20 0.35
CA3 P07451 1/20 0.35
MMP9 P14780 1/20 0.35
NFKB1 P19838 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
SCHEMBL1276170 0.96 ALDH1A1 (0.36) ALDH1A1TDP1MAPTHPGDPOLB
SCHEMBL1276656 0.82 MAPT (0.38) ALDH1A1TDP1MAPTHPGDPOLB
SCHEMBL1276641 0.78 MAPT (0.38) ALDH1A1TDP1MAPTHPGDPOLB
SCHEMBL1276100 0.76 ALDH1A1 (0.43) ALDH1A1TDP1MAPTHPGDPOLB
SCHEMBL14775320 0.74 ALDH1A1 (0.41) ALDH1A1TDP1MAPTHPGDPOLB
SCHEMBL1276822 0.73 TP53 (0.47) ALDH1A1TDP1MAPTHPGDPOLB
SCHEMBL1276096 0.73 TP53 (0.47) ALDH1A1TDP1MAPTHPGDPOLB
SCHEMBL1276810 0.72 P2RX1 (0.43) ALDH1A1POLBKDM4ELMNAHSD17B10
SCHEMBL1276500 0.72 ALDH1A1 (0.43) ALDH1A1TDP1MAPTHPGDPOLB
SCHEMBL5909751 0.72 ACHE (0.41) ALDH1A1TDP1MAPTKDM4ELMNA

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
US-8957167-B2 Polymerization process using a supported constrained geometry catalyst UNIVATION TECHNOLOGIES, LLC (US) 2015-02-17 US disclosed
EP-2459603-B1 POLYMERIZATION PROCESS USING A SUPPORTED CONSTRAINED GEOMETRY CATALYST UNIVATION TECH LLC (US) 2014-07-02 EP disclosed
EP-2459603-A1 POLYMERIZATION PROCESS USING A SUPPORTED CONSTRAINED GEOMETRY CATALYST Univation Technologies, LLC (US) 2012-06-06 EP disclosed
US-20120130032-A1 POLYMERIZATION PROCESS USING A SUPPORTED CONSTRAINED GEOMETRY CATALYST UNIVATION TECHNOLOGIES, LLC (US) 2012-05-24 US disclosed
WO-2011017092-A1 POLYMERIZATION PROCESS USING A SUPPORTED CONSTRAINED GEOMETRY CATALYST UNIVATION TECHNOLOGIES, LLC (US) 2011-02-10 WO disclosed
US-6271165-B1 SOLID COORDINATION CATALYST THE DOW CHEMICAL COMPANY 2001-08-07 US disclosed