SCHEMBL1271129

SCHEMBL1271129

O=C(CCCCc1ccccc1)N(O)Cc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 8/20 1.00
KDM4A O75164 3/20 0.69
KDM4C Q9H3R0 3/20 0.69
KDM5A P29375 1/20 0.69
PHF8 Q9UPP1 1/20 0.69
KDM2A Q9Y2K7 1/20 0.69
MAPT P10636 1/20 0.58
RXFP1 Q9HBX9 1/20 0.58
HDAC1 Q13547 2/20 0.52
HDAC2 Q92769 2/20 0.52
HDAC3 O15379 1/20 0.52
MAPK1 P28482 1/20 0.52
ADRA1A P35348 1/20 0.52
HDAC4 P56524 1/20 0.52
SLC6A3 Q01959 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HDAC7 Q8WUI4 1/20 0.52
HDAC10 Q969S8 1/20 0.52
HDAC11 Q96DB2 1/20 0.52
HDAC8 Q9BY41 1/20 0.52

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
SCHEMBL9835077 0.95 ALOX5 (1.00) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL10691673 0.86 ALOX5 (0.90) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL28234595 0.83 ALOX5 (0.73) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL9833833 0.81 ALOX5 (1.00) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL10695244 0.81 ALOX5 (1.00) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL7129964 0.80 ALOX5 (0.66) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL9662985 0.79 ALOX5 (0.97) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL9836112 0.79 ALOX5 (0.67) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL386559 0.79 ALOX5 (0.77) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL9504638 0.78 ALOX5 (0.64) ALOX5HDAC1HDAC3HDAC7HDAC10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1812010-A2 USE OF NA+/ K+-ATPASE INHIBITORS AND ANTAGONISTS THEREOF BTG International Limited (GB) 2007-08-01 EP claimed
WO-2006044916-A2 USE OF NA+/ K+-ATPASE INHIBITORS AND ANTAGONISTS THEREOF BIONAUT PHARMACEUTICALS, INC. (US) 2006-04-27 WO claimed
US-5861268-A ENZYME INHIBITORS AND CELLS BIOMIDE INVESTMENT LIMITED PARTNERSHIP (US) 1999-01-19 US claimed
US-20220257614-A1 USE OF 12-LIPOXYGENASE INHIBITORS IN THE TREATMENT OF COVID-19 NEW YORK MEDICAL COLLEGE 2022-08-18 US disclosed
US-20170327827-A1 ADIPOCYTE-SPECIFIC CONSTRUCTS AND METHODS FOR INHIBITING PLATELET-TYPE 12 LIPOXYGENASE EXPRESSION THE MEDICAL RESEARCH, INFRASTRUCTURE, AND HEALTH SERVICES FUND OF THE TEL AVIV MEDICAL CENTER (IL) 2017-11-16 US disclosed
US-9663790-B2 Adipocyte-specific constructs and methods for inhibiting platelet-type 12 lipoxygenase expression THE MEDICAL RESEARCH, INFRASTRUCTURE, AND HEALTH SERVICES FUND OF THE TEL AVIV MEDICAL CENTER (IL) 2017-05-30 US disclosed
US-9279127-B2 Adipocyte-specific constructs and methods for inhibiting platelet-type 12 lipoxygenase expression THE MEDICAL RESEARCH FUND AT THE TEL-AVIV SOURASKY MEDICAL CENTER (IL) 2016-03-08 US disclosed
US-20150191734-A1 ADIPOCYTE-SPECIFIC CONSTRUCTS AND METHODS FOR INHIBITING PLATELET-TYPE 12 LIPOXYGENASE EXPRESSION THE MEDICAL RESEARCH, INFRASTRUCTURE, AND HEALTH SERVICES FUND OF THE TEL AVIV MEDICAL CENTER (IL) 2015-07-09 US disclosed
EP-2078079-B1 ADIPOCYTE-SPECIFIC CONSTRUCTS AND METHODS FOR INHIBITING PLATELET-TYPE 12 LIPOXYGENASE EXPRESSION MEDICAL RES AND INFRASTRUCTURE FUND OF THE TEL AVIV SOURASKY MEDICAL CT (IL) 2011-05-04 EP disclosed
US-20110038923-A1 ADIPOCYTE-SPECIFIC CONSTRUCTS AND METHODS FOR INHIBITING PLATELET-TYPE 12 LIPOXYGENASE EXPRESSION THE MEDICAL RESEARCH, INFRASTRUCTURE, AND HEALTH SERVICES FUND OF THE TEL AVIV MEDICAL CENTER (IL) 2011-02-17 US disclosed
EP-2078079-A2 ADIPOCYTE-SPECIFIC CONSTRUCTS AND METHODS FOR INHIBITING PLATELET-TYPE 12 LIPOXYGENASE EXPRESSION The Medical Research and Infrastructure Fund of the Tel-Aviv Sourasky Medical Center (IL) 2009-07-15 EP disclosed
EP-1812010-A2 USE OF NA+/ K+-ATPASE INHIBITORS AND ANTAGONISTS THEREOF BTG International Limited (GB) 2007-08-01 EP disclosed
US-20060135443-A1 Use of Na*/K*-ATPase inhibitors and antagonists thereof BIONAUT PHARMACEUTICALS, INC. (US) 2006-06-22 US disclosed
WO-2006044916-A2 USE OF NA+/ K+-ATPASE INHIBITORS AND ANTAGONISTS THEREOF BIONAUT PHARMACEUTICALS, INC. (US) 2006-04-27 WO disclosed
EP-1047437-A4 SEA CUCUMBER CAROTENOID LIPID FRACTION PRODUCTS AND METHODS OF USE COLLIN PETER DONALD (US) 2004-03-03 EP disclosed
US-6399105-B1 LIPOXYGENASE INHIBITORS FOR INFLAMMATORY AUTOIMMUNE DISEASES COLLIN PETER DONALD (US) 2002-06-04 US disclosed
EP-1047437-A1 SEA CUCUMBER CAROTENOID LIPID FRACTION PRODUCTS AND METHODS OF USE Collin, Peter Donald (US) 2000-11-02 EP disclosed
WO-1999037314-A1 SEA CUCUMBER CAROTENOID LIPID FRACTION PRODUCTS AND METHODS OF USE COLLIN PETER DONALD (US) 1999-07-29 WO disclosed
US-5861268-A ENZYME INHIBITORS AND CELLS BIOMIDE INVESTMENT LIMITED PARTNERSHIP (US) 1999-01-19 US disclosed
US-5861268-A ENZYME INHIBITORS AND CELLS BIOMIDE INVESTMENT LIMITED PARTNERSHIP (US) 1999-01-19 US 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 (1 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-20060135443-A1 Use of Na*/K*-ATPase inhibitors and antagonists thereof ATP1A4, ATP1A2, ATP6V1B2 ALOX5 4133/4885KDM4A 604/4885KDM4C 606/4885

“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.