SCHEMBL69493

SCHEMBL69493

Oc1cc(O)c(Br)cc1Br

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.50
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA4 P22748 1/20 0.45
CA6 P23280 1/20 0.45
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HSP90AA1 P07900 2/20 0.36
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRA2 P47869 1/20 0.36
GABRB2 P47870 1/20 0.36
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
HPGD P15428 1/20 0.36
CASP1 P29466 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL4048113 0.89 ALOX15 (0.48) ALOX15CA1CA2CA4CA6
SCHEMBL48448 0.88 ALOX15 (0.53) ALOX15CA1CA2CA4CA6
SCHEMBL29705988 0.79 ALOX15 (0.46) ALOX15CA1CA2CA4CA6
SCHEMBL2368577 0.79 ALOX15 (0.46) ALOX15CA1CA2CA4CA6
SCHEMBL29705950 0.79 ALOX15 (0.46) ALOX15CA1CA2CA4CA6
SCHEMBL12484114 0.79 ALOX15 (0.46) ALOX15CA1CA2CA4CA6
SCHEMBL12483710 0.79 ALOX15 (0.46) ALOX15CA1CA2CA4CA6
SCHEMBL2367985 0.79 ALOX15 (0.46) ALOX15CA1CA2CA4CA6
SCHEMBL29815372 0.79 ALOX15 (0.46) ALOX15CA1CA2CA4CA6
SCHEMBL1134914 0.78 ALOX15 (0.40) ALOX15CA1CA2CA4CA6

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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9981887-B1 Synthesis of phenylethynylbenzenes THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2018-05-29 US claimed
US-7524966-B2 Method for preparing ladderanes UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2009-04-28 US claimed
US-20090088572-A1 METHOD FOR PREPARING LADDERANES NATIONAL SCIENCE FOUNDATION 2009-04-02 US claimed
WO-2007089785-A2 APPARATUS AND SEMICONDUCTOR CO-CRYSTAL UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2007-08-09 WO claimed
WO-2005035473-A2 METHOD FOR PREPARING LADDERANES FROM PRE-ORIENTED POLYENES UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2005-04-21 WO claimed
US-20200299671-A1 IMMOBILIZED MULTI-ENZYMATIC HALOGENATION SYSTEM UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2020-09-24 US disclosed
US-20180273722-A1 RESIN COMPOSITION ZEON CORPORATION (JP) 2018-09-27 US disclosed
EP-3345971-A1 RESIN COMPOSITION Zeon Corporation (JP) 2018-07-11 EP disclosed
US-9981887-B1 Synthesis of phenylethynylbenzenes THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2018-05-29 US disclosed
US-9981887-B1 Synthesis of phenylethynylbenzenes THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2018-05-29 US disclosed
US-9981887-B1 Synthesis of phenylethynylbenzenes THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2018-05-29 US disclosed
US-9705096-B2 Organic transistor, compound, organic semiconductor material for non-light-emitting organic semiconductor device, material for organic transistor, coating solution for non-light-emitting organic semiconductor device, organic semiconductor film for non-light-emitting organic semiconductor device, and method for manufacturing organic semiconductor film for non-light emitting organic semiconductor device FUJIFILM CORPORATION (JP) 2017-07-11 US disclosed
US-20070178621-A1 Apparatus and semiconductor co-crystal UNIVERISTY OF IOWA RESEARCH FOUNDATION 2007-08-02 US disclosed
WO-2005035473-A2 METHOD FOR PREPARING LADDERANES FROM PRE-ORIENTED POLYENES UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2005-04-21 WO disclosed
EP-0664014-B1 NLO SIDE CHAIN POLYMERS HAVING LOW OPTICAL LOSS AKZO NOBEL NV (NL) 1998-08-19 EP disclosed
EP-0824096-A2 Process for the preparation of halogenated (meth)acrylic esters and poly (meth) arcylates obtained with said (meth)acrylic esters Akzo Nobel N.V. (NL) 1998-02-18 EP disclosed
EP-0664014-A1 NLO SIDE CHAIN POLYMERS HAVING LOW OPTICAL LOSS Akzo Nobel N.V. (NL) 1995-07-26 EP disclosed
WO-1994008269-A1 NLO SIDE CHAIN POLYMERS HAVING LOW OPTICAL LOSS AKZO NOBEL N.V. (NL) 1994-04-14 WO disclosed
US-4020073-A Process for O-acylating thallus salts of 2-pyridone TAYLOR EDWARD C 1977-04-26 US disclosed
US-3947488-A O-Acylation using organothallium compounds TAYLOR EDWARD C 1976-03-30 US disclosed