SCHEMBL491335

SCHEMBL491335

O=C(O)Cc1cc(-c2ccc(O)cc2)cc(-c2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXRA P19793 8/20 0.63
RXRG P48443 8/20 0.63
RXRB P28702 7/20 0.63
PPARD Q03181 8/20 0.61
PPARA Q07869 3/20 0.61
PSEN1 P49768 1/20 0.58
PSEN2 P49810 1/20 0.58
APH1B Q8WW43 1/20 0.58
NCSTN Q92542 1/20 0.58
APH1A Q96BI3 1/20 0.58
PSENEN Q9NZ42 1/20 0.58
KIF11 P52732 1/20 0.58
PTPN2 P17706 2/20 0.52
PTPN1 P18031 2/20 0.52
PTPN6 P29350 2/20 0.52
PPARG P37231 1/20 0.50

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
SCHEMBL491483 0.94 RXRA (0.71) RXRARXRGRXRBPPARDPPARA
SCHEMBL491624 0.89 RXRA (0.65) RXRARXRGRXRBPPARDPPARA
SCHEMBL2272003 0.82 RXRA (0.77) RXRARXRGRXRBPPARDPPARA
SCHEMBL491523 0.81 PPARD (0.57) RXRARXRGRXRBPPARDPPARA
SCHEMBL11960675 0.81 PPARD (0.60) RXRARXRGRXRBPPARDPPARA
SCHEMBL3574038 0.81 PPARD (0.67) RXRARXRGRXRBPPARDPPARA
SCHEMBL6267349 0.80 PSEN1 (0.64) RXRARXRGRXRBPPARDPSEN1
SCHEMBL478042 0.79 PPARD (0.65) RXRARXRGRXRBPPARDPPARA
SCHEMBL9895027 0.78 RXRA (0.57) RXRARXRGRXRBPPARDPPARA
SCHEMBL3573491 0.77 PPARD (0.62) RXRARXRGRXRBPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2016039-B1 TERPHENYL DERIVATIVES FOR TREATMENT OF ALZHEIMER' S DISEASE ORTHO MCNEIL JANSSEN PHARM (US) 2012-08-01 EP claimed
US-8106236-B2 Triaryl compounds and derivates thereof ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2012-01-31 US claimed
US-20070254957-A1 TRIARYL COMPOUNDS AND DERIVATES THEREOF ORTHO-MCNEIL PHARMACEUTICAL, INC. 2007-11-01 US claimed
EP-1847524-A1 Terphenyl derivatives for treatment of Alzheimer's disease Cellzome (UK) Ltd. (GB) 2007-10-24 EP claimed
US-8106236-B2 Triaryl compounds and derivates thereof ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2012-01-31 US disclosed
EP-1847524-B1 Terphenyl derivatives for treatment of Alzheimer's disease CELLZOME LTD (GB) 2009-10-14 EP disclosed
US-20070254957-A1 TRIARYL COMPOUNDS AND DERIVATES THEREOF ORTHO-MCNEIL PHARMACEUTICAL, INC. 2007-11-01 US disclosed
EP-1847524-A1 Terphenyl derivatives for treatment of Alzheimer's disease Cellzome (UK) Ltd. (GB) 2007-10-24 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 (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-20070254957-A1 TRIARYL COMPOUNDS AND DERIVATES THEREOF BACE1, BACE2, APP RXRA 1179/4885RXRG 1200/4885RXRB 1173/4885

“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.