SCHEMBL6346017

SCHEMBL6346017

CC(C)Cc1ccc(O)c(O)c1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.61
GABRB2 P47870 2/20 0.61
ELANE P08246 2/20 0.46
CTSG P08311 1/20 0.46
KDM4E B2RXH2 3/20 0.42
HPGD P15428 3/20 0.42
HSD17B10 Q99714 3/20 0.42
USP2 O75604 2/20 0.42
RNASEH1 O60930 1/20 0.39
ALOX15 P16050 3/20 0.38
ALOX12 P18054 3/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 2/20 0.38
ESR1 P03372 2/20 0.38
TP53 P04637 2/20 0.38
CYP3A4 P08684 2/20 0.38
MAPK1 P28482 2/20 0.38
RECQL P46063 2/20 0.38
KMT2A Q03164 2/20 0.38
HIF1A Q16665 2/20 0.38

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
SCHEMBL5587185 0.91 GABRA1 (0.73) GABRA1GABRB2ELANECTSGKDM4E
SCHEMBL31015759 0.83 GABRA1 (0.52) GABRA1GABRB2ELANECTSGKDM4E
SCHEMBL2951870 0.81 GABRA1 (0.55) GABRA1GABRB2ELANECTSGKDM4E
SCHEMBL1053654 0.80 GABRA1 (0.79) GABRA1GABRB2ELANECTSGHPGD
SCHEMBL17878527 0.78 GABRA1 (0.57) GABRA1GABRB2ELANECTSGKDM4E
SCHEMBL6343668 0.78 TYR (0.43) GABRA1GABRB2
SCHEMBL23387408 0.77 GABRA1 (0.61) GABRA1GABRB2ELANECTSGKDM4E
SCHEMBL29079425 0.77 GABRA1 (0.61) GABRA1GABRB2ELANECTSGKDM4E
SCHEMBL864085 0.76 GABRA1 (1.00) GABRA1GABRB2ELANECTSGKDM4E
SCHEMBL276132 0.76 GABRA1 (0.52) GABRA1GABRB2ELANECTSGKDM4E

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-6878659-B2 Solid catalyst component for olefin polymerization and catalyst TOHO TITANIUM CO., LTD. (JP) 2005-04-12 US disclosed
US-20040072681-A1 Solid catalyst component for olefin polymerization and catalyst TOHO TITANIUM CO., LTD. (JP) 2004-04-15 US disclosed
EP-1260524-A1 SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION AND CATALYST Toho Titanium Co., Ltd. (JP) 2002-11-27 EP disclosed
EP-0411150-B1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMA CO LTD (JP) 1996-11-27 EP disclosed
US-5238938-A Nephrosis OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-08-24 US disclosed
EP-0411150-A1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-02-06 EP disclosed