SCHEMBL1885191

SCHEMBL1885191

CCCCSc1c(CC(C)(C)C(=O)O)n(Cc2ccc(Cl)cc2)c2ccc(OCc3ccc4ccccc4n3)cc12

nearest known ligand 0.81

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 19/20 0.81
ALOX5 P09917 7/20 0.81
CYP3A4 P08684 2/20 0.81
CYP2C9 P11712 2/20 0.81
CYP2D6 P10635 1/20 0.81
PTGS1 P23219 1/20 0.72
PTGS2 P35354 1/20 0.72

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
Quiflapon SCHEMBL30505315 0.89 ALOX5AP (1.00) ALOX5APALOX5CYP3A4CYP2C9CYP2D6
Quiflapon SCHEMBL29370879 0.89 ALOX5AP (1.00) ALOX5APALOX5CYP3A4CYP2C9CYP2D6
Quiflapon SCHEMBL502947 0.89 ALOX5AP (1.00) ALOX5APALOX5CYP3A4CYP2C9CYP2D6
Quiflapon SCHEMBL29372303 0.89 ALOX5AP (1.00) ALOX5APALOX5CYP3A4CYP2C9CYP2D6
Quiflapon SCHEMBL9306842 0.89 ALOX5AP (0.98) ALOX5APALOX5CYP3A4CYP2C9CYP2D6
Quiflapon SCHEMBL9306864 0.89 ALOX5AP (0.98) ALOX5APALOX5CYP3A4CYP2C9CYP2D6
SCHEMBL2109531 0.89 ALOX5AP (0.85) ALOX5APALOX5CYP3A4CYP2C9CYP2D6
SCHEMBL2108478 0.87 ALOX5AP (1.00) ALOX5APALOX5CYP3A4CYP2C9CYP2D6
SCHEMBL3775490 0.86 ALOX5AP (0.81) ALOX5APALOX5CYP3A4CYP2C9CYP2D6
SCHEMBL2108907 0.86 PTGS1 (0.87) ALOX5APALOX5CYP3A4CYP2C9CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150320697-A1 Methods For Bone Treatment By Modulating An Arachidonic Acid Metabolic or Signaling Pathway ACCELALOX, INC. 2015-11-12 US claimed
EP-1947942-B1 METHODS FOR BONE TREATMENT BY MODULATING AN ARACHIDONIC ACID METABOLIC OR SIGNALING PATHWAY ACCELALOX INC (US) 2015-07-29 EP claimed
US-8980851-B2 Methods for bone treatment by modulating an arachidonic acid metabolic or signaling pathway ACCELALOX, INC. (US) 2015-03-17 US claimed
WO-2014031586-A2 METHODS FOR TREATING CARDIOVASCULAR DISEASES TALLIKUT PHARMACEUTICALS, INC. (US) 2014-02-27 WO claimed
US-20110124717-A1 Methods for Bone Treatment by Modulating an Arachidonic Acid Metabolic or Signaling Pathway ACCELALOX, INC. (US) 2011-05-26 US claimed
US-7829535-B2 for promoting osteogenesis to accelerate or enhance bone fracture healing, treat bone defects, and enhance bone formation are disclosed. The methods modulate an arachidonic acid metabolic or signaling pathway in general, and, in particular, utilize 5-lipoxygenase inhibitors. ACCELALOX, INC. (US) 2010-11-09 US claimed
US-20080280826-A1 for promoting osteogenesis to accelerate or enhance bone fracture healing, treat bone defects, and enhance bone formation are disclosed. The methods modulate an arachidonic acid metabolic or signaling pathway in general, and, in particular, utilize 5-lipoxygenase inhibitors. ACCELALOX, INC. (US) 2008-11-13 US claimed
WO-1993010115-A1 AMORPHOUS (QUINOLIN-2-YLMETHOXY) INDOLES AS LEUKOTRIENE ANTAGONISTS MERCK FROSST CANADA INC. (CA) 1993-05-27 WO claimed
US-20150320697-A1 Methods For Bone Treatment By Modulating An Arachidonic Acid Metabolic or Signaling Pathway ACCELALOX, INC. 2015-11-12 US disclosed
EP-1947942-B1 METHODS FOR BONE TREATMENT BY MODULATING AN ARACHIDONIC ACID METABOLIC OR SIGNALING PATHWAY ACCELALOX INC (US) 2015-07-29 EP disclosed
US-8980851-B2 Methods for bone treatment by modulating an arachidonic acid metabolic or signaling pathway ACCELALOX, INC. (US) 2015-03-17 US disclosed
WO-2014031586-A2 METHODS FOR TREATING CARDIOVASCULAR DISEASES TALLIKUT PHARMACEUTICALS, INC. (US) 2014-02-27 WO disclosed
US-20110269807-A1 NOVEL TREATMENT FOR AGE RELATED MACULAR DEGENERATION AND OCULAR ISCHEMIC DISEASE ASSOCIATED WITH COMPLEMENT ACTIVATION BY TARGETING 5-LIPOXYGENASE ALLERGAN, INC. (US) 2011-11-03 US disclosed
US-20110124717-A1 Methods for Bone Treatment by Modulating an Arachidonic Acid Metabolic or Signaling Pathway ACCELALOX, INC. (US) 2011-05-26 US disclosed
US-20040198800-A1 Lipoxygenase inhibitors as hypolipidemic and anti-hypertensive agents INSMED INCORPORATED 2004-10-07 US disclosed
US-6756399-B2 INHIBITORS OF ENZYMES THAT METABOLIZE ARACHIDONIC ACID; PEROXISOME PROLIFERATOR-ACTIVATED RECEPTORS (PPAR) THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES 2004-06-29 US disclosed
US-20030082108-A1 Inhibitors of enzymes that metabolize arachidonic acid; peroxisome proliferator-activated receptors (ppar) GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF THE ARMY, THE 2003-05-01 US disclosed
US-6071949-A FOR TREATMENT OF CANCERS DERIVED FROM EPITHELIAL CELLS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2000-06-06 US disclosed
EP-0750496-A1 USE OF LIPOXYGENASE INHIBITORS AS ANTI-CANCER THERAPEUTIC AND INTERVENTION AGENTS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, as represented by THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1997-01-02 EP disclosed
WO-1995024894-A2 USE OF LIPOXYGENASE INHIBITORS AS ANTI-CANCER THERAPEUTIC AND INTERVENTION AGENTS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1995-09-21 WO 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 (2 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-20110269807-A1 NOVEL TREATMENT FOR AGE RELATED MACULAR DEGENERATION AND OCULAR ISCHEMIC DISEASE ASSOCIATED WITH COMPLEMENT ACTIVATION BY TARGETING 5-LIPOXYGENASE ALOX15B, ALOX5, ALOX15 ALOX5AP 5/4885ALOX5 2/4885CYP3A4 3178/4885
US-20040198800-A1 Lipoxygenase inhibitors as hypolipidemic and anti-hypertensive agents ALOX5, ALOX15, ALOX15B ALOX5AP 7/4885ALOX5 1/4885CYP3A4 665/4885

“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.