SCHEMBL2954809

SCHEMBL2954809

OCc1ccc(Oc2ccccc2F)cc1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.60
PARP10 Q53GL7 1/20 0.56
LPAR1 Q92633 15/20 0.52
LPAR5 Q9H1C0 15/20 0.52
TTR P02766 1/20 0.50
DAO P14920 1/20 0.49

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
SCHEMBL6293051 0.84 PARP10 (0.66) PARP10LPAR1LPAR5DAO
SCHEMBL6289863 0.82 PARP10 (0.63) PARP10LPAR1LPAR5DAO
SCHEMBL2091496 0.81 PARP10 (0.51) PARP10LPAR1LPAR5DAO
SCHEMBL3520758 0.81 PARP10 (0.51) PARP10LPAR1LPAR5DAO
SCHEMBL28770201 0.81 PARP10 (0.56) PARP10LPAR1LPAR5DAO
SCHEMBL10689395 0.81 PARP10 (0.51) PARP10LPAR1LPAR5DAO
SCHEMBL507282 0.81 MAOB (0.56) PARP10LPAR1LPAR5DAO
SCHEMBL6158567 0.81 DAO (0.52) PARP10LPAR1LPAR5TTRDAO
SCHEMBL2354368 0.81 TTR (0.50) LTA4HPARP10LPAR1LPAR5TTR
SCHEMBL920137 0.81 PARP10 (0.51) LTA4HPARP10LPAR1LPAR5DAO

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-0179788-B1 PESTICIDES NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1991-06-12 EP claimed
EP-0179788-A1 PESTICIDES. NAT RES DEV (GB) 1986-05-07 EP claimed
EP-0161921-A2 Improvements relating to pesticides BTG INTERNATIONAL LIMITED (GB) 1985-11-21 EP claimed
WO-1985004651-A1 IMPROVEMENTS RELATING TO PESTICIDES NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1985-10-24 WO claimed
US-7772237-B2 Thio-substituted tricyclic and bicyclic aromatic methanesulfinyl derivatives CEPHALON FRANCE (FR) 2010-08-10 US disclosed
US-20090105241-A1 THIO-SUBSTITUTED TRICYCLIC AND BICYCLIC AROMATIC METHANESULFINYL DERIVATIVES CEPHALON FRANCE (FR) 2009-04-23 US disclosed
US-7476690-B2 Thio-substituted tricyclic and bicyclic aromatic methanesulfinyl derivatives CEPHALON FRANCE (FR) 2009-01-13 US disclosed
EP-1735300-A1 THIO-SUBSTITUTED TRICYCLIC AND BICYCLIC AROMATIC METHANESULFINYL DERIVATIVES CEPHALON FRANCE (FR) 2006-12-27 EP disclosed
US-20060241119-A1 Thio-substituted tricyclic and bicyclic aromatic methanesulfinyl derivatives CEPHALON FRANCE (FR) 2006-10-26 US disclosed
US-7119214-B2 Thio-substituted tricyclic and bicyclic aromatic methanesulfinyl derivatives CEPHALON FRANCE (FR) 2006-10-10 US disclosed
US-20050282821-A1 Thio-substituted tricyclic and bicyclic aromatic methanesulfinyl derivatives CEPHALON FRANCE (FR) 2005-12-22 US disclosed
WO-2005100345-A1 THIO-SUBSTITUTED TRICYCLIC AND BICYCLIC AROMATIC METHANESULFINYL DERIVATIVES CEPHALON FRANCE (FR) 2005-10-27 WO disclosed
EP-1589016-A1 Thio-substituted tricyclic and bicyclic aromatic methanesulfinyl derivatives CEPHALON FRANCE (FR) 2005-10-26 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-20050282821-A1 Thio-substituted tricyclic and bicyclic aromatic methanesulfinyl derivatives HTR1A, HTR2A, HTR5A LTA4H 4281/4885PARP10 3776/4885LPAR1 1585/4885
US-20060241119-A1 Thio-substituted tricyclic and bicyclic aromatic methanesulfinyl derivatives HTR1A, HTR2A, HTR5A LTA4H 4281/4885PARP10 3776/4885LPAR1 1585/4885
US-20090105241-A1 THIO-SUBSTITUTED TRICYCLIC AND BICYCLIC AROMATIC METHANESULFINYL DERIVATIVES HTR1A, HTR2A, HTR5A LTA4H 4281/4885PARP10 3776/4885LPAR1 1585/4885

“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.