SCHEMBL4439740

SCHEMBL4439740

COc1cc(O)c(O)c2c1O[C@@H](c1ccccc1)CC2=O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.74
POLB P06746 2/20 0.72
MEN1 O00255 2/20 0.72
MAPT P10636 2/20 0.72
KMT2A Q03164 2/20 0.72
GAA P10253 1/20 0.72
PABPC1 P11940 1/20 0.72
APEX1 P27695 1/20 0.72
RECQL P46063 1/20 0.72
EIF4H Q15056 1/20 0.72
L3MBTL1 Q9Y468 1/20 0.72
ABCG2 Q9UNQ0 5/20 0.63
ABCB1 P08183 2/20 0.63
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
PLK1 P53350 1/20 0.58
HSD17B10 Q99714 3/20 0.57
KDM4E B2RXH2 2/20 0.57
ALDH1A1 P00352 2/20 0.57
HPGD P15428 2/20 0.57

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
SCHEMBL17907266 0.89 MEN1 (0.86) CYP19A1POLBMEN1MAPTKMT2A
SCHEMBL28045887 0.85 CYP19A1 (0.78) CYP19A1POLBMEN1MAPTKMT2A
SCHEMBL1068874 0.84 PLK1 (0.67) CYP19A1POLBMEN1MAPTKMT2A
SCHEMBL28513250 0.84 MEN1 (0.74) CYP19A1POLBMEN1MAPTKMT2A
SCHEMBL665265 0.84 CYP19A1 (0.84) CYP19A1POLBMEN1MAPTKMT2A
SCHEMBL27715512 0.80 PLK1 (0.68) CYP19A1POLBMEN1MAPTKMT2A
SCHEMBL29204369 0.80 NPC1 (0.67) CYP19A1POLBMEN1MAPTKMT2A
SCHEMBL9063227 0.80 CYP19A1 (0.70) CYP19A1POLBMEN1MAPTKMT2A
SCHEMBL3364494 0.80 MEN1 (0.65) CYP19A1POLBMEN1MAPTKMT2A
SCHEMBL17907269 0.79 MEN1 (0.67) CYP19A1POLBMEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1429602-B1 METHODS FOR TREATING DISORDERS USING PLANT EXTRACTS UNIV RUTGERS (US) 2009-12-16 EP disclosed
EP-1429602-A4 METHODS FOR TREATING DISORDERS USING PLANT EXTRACTS UNIV RUTGERS (US) 2005-12-21 EP disclosed
US-6893627-B2 Method for treating type 2 diabetes with an extract of Artemisia RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2005-05-17 US disclosed
US-20050069598-A1 Methods for treating disorders using plant extracts RIBNICKY DAVID M (US) 2005-03-31 US disclosed
EP-1429602-A1 METHODS FOR TREATING DISORDERS USING PLANT EXTRACTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2004-06-23 EP disclosed
US-20030072822-A1 Methods for treating disorders using plant extracts RUTGERS, THE STATE OF UNIVERSITY OF NEW JERSEY 2003-04-17 US disclosed
WO-2003020026-A1 METHODS FOR TREATING DISORDERS USING PLANT EXTRACTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2003-03-13 WO disclosed