SCHEMBL459980

SCHEMBL459980

CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)C(F)(F)F

nearest known ligand 0.93

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 12/20 0.93
PLA2G4A P47712 2/20 0.93
ALDH1A1 P00352 2/20 0.93
PLA2G4B P0C869 1/20 0.93
MAPT P10636 1/20 0.93
BLM P54132 1/20 0.93
MGLL Q99685 1/20 0.93
PLA2G4C Q9UP65 1/20 0.93
CES1 P23141 7/20 0.87
CES2 O00748 2/20 0.67
MEN1 O00255 1/20 0.67
CYP1A2 P05177 1/20 0.67
KMT2A Q03164 1/20 0.67
HSD17B10 Q99714 1/20 0.67
FFAR1 O14842 2/20 0.64
ESR1 P03372 1/20 0.64
F7 P08709 1/20 0.64
F3 P13726 1/20 0.64
PTGS1 P23219 1/20 0.64
SRD5A2 P31213 1/20 0.64

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
SCHEMBL459981 1.00 FAAH (0.93) FAAHPLA2G4AALDH1A1PLA2G4BMAPT
SCHEMBL3679974 0.98 FAAH (0.90) FAAHPLA2G4AALDH1A1PLA2G4BMAPT
SCHEMBL3679976 0.98 FAAH (0.90) FAAHPLA2G4AALDH1A1PLA2G4BMAPT
SCHEMBL22195368 0.97 FAAH (0.88) FAAHPLA2G4AALDH1A1PLA2G4BMAPT
Arachidonyl Trifluoromethylketone SCHEMBL9880640 0.97 FAAH (1.00) FAAHPLA2G4AALDH1A1PLA2G4BMAPT
Arachidonyl Trifluoromethylketone SCHEMBL30426991 0.97 FAAH (1.00) FAAHPLA2G4AALDH1A1PLA2G4BMAPT
SCHEMBL24939095 0.93 FAAH (1.00) FAAHPLA2G4AALDH1A1PLA2G4BMAPT
SCHEMBL24938529 0.93 FAAH (1.00) FAAHPLA2G4AALDH1A1PLA2G4BMAPT
SCHEMBL8059738 0.93 FAAH (1.00) FAAHPLA2G4AALDH1A1PLA2G4BMAPT
SCHEMBL4085373 0.93 FAAH (1.00) FAAHPLA2G4AALDH1A1PLA2G4BMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024073476-A2 COMPOSITIONS AND METHODS FOR TREATING CANCER BY REDUCING THE EXPRESSION AND/OR ACTIVITY OF PLA2G10 YALE UNIVERSITY (US) 2024-04-04 WO claimed
US-20230060937-A1 SIMULTANEOUS GENE EDITING AND HAPLOID INDUCTION SYNGENTA PARTICIPATIONS AG (CH) 2023-03-02 US claimed
EP-3923962-A2 GENE NETWORKS THAT MEDIATE REMYELINATION OF THE HUMAN BRAIN University of Rochester (US) 2021-12-22 EP claimed
EP-3899016-A1 SIMULTANEOUS GENE EDITING AND HAPLOID INDUCTION Syngenta Participations AG (CH) 2021-10-27 EP claimed
WO-2020167822-A2 GENE NETWORKS THAT MEDIATE REMYELINATION OF THE HUMAN BRAIN UNIVERSITY OF ROCHESTER (US) 2020-08-20 WO claimed
WO-2020144192-A1 USE OF ARACHIDONYL TRIFLUOROMETHYL KETONE MOSAIQUES DIAGNOSTICS UND THERAPEUTICS AG (DE) 2020-07-16 WO claimed
EP-3677259-A1 USE OF ARACHIDONYL TRIFLUOROMETHYL KETONE Mosaiques Diagnostics And Therapeutics AG (DE) 2020-07-08 EP claimed
WO-2020131788-A1 SIMULTANEOUS GENE EDITING AND HAPLOID INDUCTION SYNGENTA PARTICIPATIONS AG (CH) 2020-06-25 WO claimed
EP-3547825-A1 SIMULTANEOUS GENE EDITING AND HAPLOID INDUCTION Syngenta Participations AG (CH) 2019-10-09 EP claimed
US-9999603-B2 Compositions and methods including leelamine and arachidonyl trifluoromethyl ketone relating to treatment of cancer THE PENN STATE RESEARCH FOUNDATION (US) 2018-06-19 US claimed
US-20060058225-A1 Used of inhibitors of phospholipase a2 for the treatment, prevention or diagnosis of neural inflammatory or demyelinating disease MCGILL UNIVERSITY 2006-03-16 US claimed
EP-1294411-A4 A NOVEL TREATMENT FOR COUGH UNIV CALIFORNIA (US) 2006-02-01 EP claimed
WO-2005107766-A1 PHOSPHOLIPASE INHIBITORS LOCALIZED IN THE GASTROINTESTINAL LUMEN ILYPSA, INC. (US) 2005-11-17 WO claimed
US-20050244367-A1 Phospholipase inhibitors localized in the gastrointestinal lumen ILYPSA, INC. (US) 2005-11-03 US claimed
EP-1509247-A1 USE OF INHIBITORS OF PHOSPHOLIPASE A2 FOR THE TREATMENT, PREVENTION OR DIAGNOSIS OF NEURAL INFLAMMATORY OR DEMYELINATING DIESEASES McGILL UNIVERSITY (CA) 2005-03-02 EP claimed
WO-2003101487-A1 USE OF INHIBITORS OF PHOSPHOLIPASE A2 FOR THE TREATMENT, PREVENTION OR DIAGNOSIS OF NEURAL INFLAMMATORY OR DEMYELINATING DISEASE MCGILL UNIVERSITY (CA) 2003-12-11 WO claimed
US-20030225011-A1 Phospholipase A2 expression and activity and use thereof for diagnosis, prognostication, prevention and treatment of neural inflammatory and demyelinating disease MCGILL UNIVERSITY (CA) 2003-12-04 US claimed
EP-1294411-A1 A NOVEL TREATMENT FOR COUGH THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2003-03-26 EP claimed
US-20020035150-A1 Novel treatment for cough REGENTS OF THE UNIVERSITY OF CALIFORNIA, THE 2002-03-21 US claimed
WO-2001089589-A1 A NOVEL TREATMENT FOR COUGH THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2001-11-29 WO claimed

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-20020035150-A1 Novel treatment for cough CNR1, CNR2, TRPV1 FAAH 14/4885PLA2G4A 1002/4885ALDH1A1 3682/4885
US-20050244367-A1 Phospholipase inhibitors localized in the gastrointestinal lumen PNLIP, PLA2G2E, PLA2G4B FAAH 142/4885PLA2G4A 5/4885ALDH1A1 3621/4885

“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.