SCHEMBL3972455

SCHEMBL3972455

O=C(O)CC(=O)CC1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.50
HPGD P15428 3/20 0.50
KMT2A Q03164 1/20 0.50
EPHX2 P34913 2/20 0.46
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
LMNA P02545 1/20 0.41
CYP2D6 P10635 1/20 0.41
ADH1B P00325 1/20 0.40
ADH1C P00326 1/20 0.40
ADH1A P07327 1/20 0.40
ADH4 P08319 1/20 0.40
ADH7 P40394 1/20 0.40
ALDH1A1 P00352 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP3 P08254 1/20 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
SCHEMBL28969694 0.98 KMT2A (0.47) EPHX1HPGDKMT2AEPHX2NPC1
SCHEMBL11974545 0.88 EPHX1 (0.56) EPHX1HPGDKMT2AEPHX2NPC1
SCHEMBL17255343 0.88 LDHA (0.40) EPHX1HPGDKMT2AEPHX2LMNA
SCHEMBL9298439 0.85 EPHX1 (0.52) EPHX1HPGDKMT2AEPHX2NPC1
SCHEMBL7945281 0.83 EPHX1 (0.54) EPHX1HPGDKMT2AEPHX2NPC1
SCHEMBL1148328 0.83 EPHX1 (0.54) EPHX1HPGDKMT2AEPHX2NPC1
Cyclohexane SCHEMBL3394348 0.80 EPHX1 (0.52) EPHX1HPGDKMT2AEPHX2NPC1
SCHEMBL11098596 0.80 EPHX1 (0.52) EPHX1HPGDKMT2AEPHX2NPC1
SCHEMBL14679380 0.80 EPHX1 (0.52) EPHX1HPGDKMT2AEPHX2NPC1
SCHEMBL175425 0.80 EPHX1 (0.52) EPHX1HPGDKMT2AEPHX2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2852282-B1 METHODS FOR RENDERING MICELLAR COORDINATION COMPLEXES SAFE FOR THE TREATMENT OF PLANTS AND FORMULATIONS FOR SAME INNOVATION HAMMER LLC (US) 2019-04-24 EP disclosed
US-9828299-B2 Methods for rendering micellar coordination complexes safe for the treatment of plants and formulations for same INNOVATION HAMMER, LLC (US) 2017-11-28 US disclosed
US-20150133298-A1 Methods For Rendering Micellar Coordination Complexes Safe For The Treatment Of Plants And Formulations For Same INNOVATION HAMMER, LLC 2015-05-14 US disclosed
EP-2852282-A2 METHODS FOR RENDERING MICELLAR COORDINATION COMPLEXES SAFE FOR THE TREATMENT OF PLANTS AND FORMULATIONS FOR SAME Innovation Hammer LLC (US) 2015-04-01 EP disclosed
WO-2013176731-A2 METHODS FOR RENDERING MICELLAR COORDINATION COMPLEXES SAFE FOR THE TREATMENT OF PLANTS AND FORMULATIONS FOR SAME NONOMURA ARTHUR M (US) 2013-11-28 WO disclosed
EP-1088040-B1 Use of a crosslinking component comprising a polyamine, a polyketimine or combination thereof DU PONT (US) 2009-07-29 EP disclosed
US-6432483-B1 CURABLE LIQUID COATINGS E. I. DU PONT DE NEMOURS & COMPANY 2002-08-13 US disclosed
EP-1088040-A1 POLYACRYLICS CONTAINING PENDANT ACETOACETONATE MOIETIES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2001-04-04 EP disclosed
WO-1999060065-A1 POLYACRYLICS CONTAINING PENDANT ACETOACETONATE MOIETIES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-11-25 WO disclosed
EP-0199087-B2 A liquid coating composition and a process for coating a substrate with such coating composition AKZO NV (NL) 1993-11-10 EP disclosed
EP-0199087-B1 A LIQUID COATING COMPOSITION AND A PROCESS FOR COATING A SUBSTRATE WITH SUCH COATING COMPOSITION AKZO N.V. (NL) 1989-01-18 EP disclosed
US-4772680-A Liquid coating composition and a process for coating a substrate with such coating composition AKZO N.V. (NL) 1988-09-20 US disclosed
WO-1988002134-A1 READ-ONLY OPTICAL DATA CARD DREXLER TECHNOLOGY CORPORATION (US) 1988-03-24 WO disclosed