SCHEMBL1619622

SCHEMBL1619622

CC(C)Oc1ccc(Oc2ccc(O)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.64
MEN1 O00255 1/20 0.64
ESR1 P03372 1/20 0.64
ESR2 Q92731 1/20 0.64
LTA4H P09960 6/20 0.58
NR1H2 P55055 1/20 0.54
BAX Q07812 1/20 0.54
PNLIP P16233 1/20 0.49
PARP10 Q53GL7 2/20 0.48
ACACB O00763 2/20 0.47
ACACA Q13085 2/20 0.47
ALDH1A3 P47895 1/20 0.47
POLB P06746 1/20 0.46

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
SCHEMBL28485 0.93 KMT2A (0.56) KMT2AMEN1ESR1ESR2LTA4H
SCHEMBL6282894 0.88 ALDH1A3 (0.56) KMT2APNLIPPARP10ACACBACACA
SCHEMBL863444 0.86 ESR2 (0.58) KMT2AMEN1ESR1ESR2PARP10
SCHEMBL8002323 0.83 KMT2A (0.47) KMT2AMEN1ESR1ESR2LTA4H
SCHEMBL12019129 0.83 ESR1 (0.67) KMT2AMEN1ESR1ESR2PARP10
SCHEMBL14817450 0.81 ACACB (0.59) KMT2APNLIPPARP10ACACBACACA
SCHEMBL19847794 0.81 NR1H2 (0.56) KMT2AMEN1ESR1ESR2NR1H2
SCHEMBL5197463 0.81 ESR1 (0.56) KMT2AMEN1ESR1ESR2LTA4H
Hydrogen Peroxide SCHEMBL28902806 0.80 KMT2A (0.70) KMT2AMEN1PARP10ALDH1A3POLB
SCHEMBL3175106 0.80 ESR2 (1.00) KMT2AMEN1ESR1ESR2LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190181409-A1 HIGH TEMPERATURE MELT INTEGRITY BATTERY SEPARATORS VIA SPINNING SABIC GLOBAL TECHNOLOGIES BV (NL) 2019-06-13 US disclosed
US-10243187-B2 Process of making battery separators via spinning SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2019-03-26 US disclosed
US-10030140-B2 Fiber reinforced polyaryletherketone resin compositions SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2018-07-24 US disclosed
US-9577235-B2 High temperature melt integrity battery separators via spinning SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2017-02-21 US disclosed
EP-1996567-B1 NOVEL ACETYL-COA CARBOXYLASE (ACC) INHIBITORS AND THEIR USE IN DIABETES, OBESITY AND METABOLIC SYNDROME ABBVIE INC (US) 2013-09-18 EP disclosed
US-8207350-B2 Acetyl-CoA carboxylase (ACC) inhibitors and their use in diabetes, obesity and metabolic syndrome ABBOTT LABORATORIES (US) 2012-06-26 US disclosed
US-7928243-B2 e.g. N-{(2Z)-3-[4-(4-isopropoxyphenoxy)phenyl]-1-methylprop-2-enyl}acetamide; antidiabetic agent; type II diabetes, atherosclerosis and cardiovascular diseases ABBOTT LABORATORIES (US) 2011-04-19 US disclosed
WO-2010127208-A1 INHIBITORS OF ACETYL-COA CARBOXYLASE FOREST LABORATORIES HOLDINGS LIMITED (BM) 2010-11-04 WO disclosed
US-20090048298-A1 Novel acetyl-CoA Carboxylase (ACC) Inhibitors and their use in Diabetes, Obesity and Metabolic Syndrome ABBOTT LABORATORIES (US) 2009-02-19 US disclosed
EP-1996567-A2 NOVEL ACETYL-COA CARBOXYLASE (ACC) INHIBITORS AND THEIR USE IN DIABETES, OBESITY AND METABOLIC SYNDROME ABBOTT LABORATORIES (US) 2008-12-03 EP disclosed
US-20080161368-A1 NOVEL ACETYL-COA CARBOXYLASE (ACC) INHIBITORS AND THEIR USE IN DIABETES, OBESITY AND METABOLIC SYNDROME ABBVIE INC. 2008-07-03 US disclosed
WO-2008079610-A2 NOVEL ACETYL-COA CARBOXYLASE (ACC) INHIBITORS AND THEIR USE IN DIABETES, OBESITY AND METABOLIC SYNDROME ABBOTT LABORATORIES (US) 2008-07-03 WO disclosed
US-20070219258-A1 NOVEL ACETYL-COA CARBOXYLASE (ACC) INHIBITORS AND THEIR USE IN DIABETES, OBESITY AND METABOLIC SYNDROME ABBOTT LABORATORIES 2007-09-20 US disclosed
WO-2007095601-A2 NOVEL ACETYL-COA CARBOXYLASE (ACC) INHIBITORS AND THEIR USE IN DIABETES, OBESITY AND METABOLIC SYNDROME ABBOTT LABORATORIES (US) 2007-08-23 WO disclosed
EP-0648729-B1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL CO (JP) 1998-07-15 EP disclosed
US-5698702-A INTERMEDIATES FOR INSECTICIDES, ACARICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-12-16 US disclosed
US-5530015-A Dihaloprene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient, and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-25 US disclosed
EP-0648729-A1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-04-19 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080161368-A1 NOVEL ACETYL-COA CARBOXYLASE (ACC) INHIBITORS AND THEIR USE IN DIABETES, OBESITY AND METABOLIC SYNDROME ACACA, ACACB, ACAT1 KMT2A 3087/4885MEN1 4094/4885ESR1 4134/4885
US-20070219258-A1 NOVEL ACETYL-COA CARBOXYLASE (ACC) INHIBITORS AND THEIR USE IN DIABETES, OBESITY AND METABOLIC SYNDROME ACACA, ACACB, ACAT1 KMT2A 2737/4885MEN1 3880/4885ESR1 3805/4885
US-20090048298-A1 Novel acetyl-CoA Carboxylase (ACC) Inhibitors and their use in Diabetes, Obesity and Metabolic Syndrome ACACA, ACACB, ACAT1 KMT2A 2737/4885MEN1 3880/4885ESR1 3805/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.