SCHEMBL7709780

SCHEMBL7709780

COc1ccc(C(C)c2cc3c(cc2OC)OCO3)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.72
CYP2D6 P10635 2/20 0.72
CYP2C9 P11712 2/20 0.72
CYP2C19 P33261 2/20 0.72
CYP1A2 P05177 1/20 0.72
ALOX15 P16050 1/20 0.72
SMAD3 P84022 3/20 0.52
P4HB P07237 6/20 0.50
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48

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
SCHEMBL11083004 0.87 CYP1A2 (0.55) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL11094276 0.86 CYP3A4 (0.62) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL11091615 0.86 CYP3A4 (0.62) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL14284006 0.84 CYP3A4 (1.00) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL11090434 0.84 CYP3A4 (0.59) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL15145035 0.77 LMNA (0.51) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL13500504 0.76 CA12 (0.50) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL24598757 0.75 CYP3A4 (0.70) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL28868357 0.72 CYP3A4 (0.75) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2
SCHEMBL9860501 0.71 CYP3A4 (0.58) CYP3A4CYP2D6CYP2C9CYP2C19CYP1A2

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-6362394-B1 EXPRESSING RECEPTOR POLYPEPTIDE IN TRANSGENIC PLANT CELL; CONTACTING TRANSGENIC PLANT CELL WITH JUVENILE HORMONE OR ITS AGONISTS, WHEREIN RECEPTOR POLYPEPTIDE CONTROLS EXPRESSION OF TARGET POLYPEPTIDE IN PRESENCE OF JUVENILE HORMONE SYNGENTA PARTICIPATIONS AG (CH) 2002-03-26 US disclosed
EP-0859851-A1 JUVENILE HORMONE OR ONE OF ITS AGONISTS AS A CHEMICAL LIGAND TO CONTROL GENE EXPRESSION IN PLANTS BY RECEPTOR MEDIATED TRANSACTIVATION Novartis AG (CH) 1998-08-26 EP disclosed
WO-1997013864-A1 JUVENILE HORMONE OR ONE OF ITS AGONISTS AS A CHEMICAL LIGAND TO CONTROL GENE EXPRESSION IN PLANTS BY RECEPTOR MEDIATED TRANSACTIVATION NOVARTIS AG (CH) 1997-04-17 WO disclosed
US-4482728-A ANTIFERTILITY AGENTS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1984-11-13 US disclosed
US-4357344-A Polybutylbenzylphenols and benzyl-3,4-methylenedioxybenzenes in insect population control THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1982-11-02 US disclosed
US-4342777-A GROWTH INHIBITOR FOR MOSQUITO LARVAE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1982-08-03 US disclosed