SCHEMBL491622

SCHEMBL491622

O=C(O)c1cc(-c2ccc(Cl)cc2)cc(-c2ccc(Cl)cc2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 3/20 0.64
RXRB P28702 3/20 0.64
NOTUM Q6P988 1/20 0.61
CTRC Q99895 2/20 0.61
ALOX15 P16050 1/20 0.60
TSHR P16473 1/20 0.60
AURKA O14965 1/20 0.54
TPX2 Q9ULW0 1/20 0.54
TPMT P51580 1/20 0.54
SRD5A2 P31213 1/20 0.54
DHODH Q02127 2/20 0.53
ALAD P13716 1/20 0.52
KMO O15229 1/20 0.50
CDH1 P12830 1/20 0.50
APC P25054 1/20 0.50
CTNNB1 P35222 1/20 0.50
TCF7L2 Q9NQB0 1/20 0.50
EGFR P00533 1/20 0.50
MAP4K4 O95819 2/20 0.49
CA12 O43570 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
SCHEMBL8628997 0.87 TPMT (0.74) RXRARXRBNOTUMCTRCALOX15
SCHEMBL2723882 0.87 RXRA (0.55) RXRARXRBNOTUMCTRCALOX15
SCHEMBL29727618 0.87 RXRA (0.55) RXRARXRBNOTUMCTRCALOX15
SCHEMBL18496631 0.87 RXRA (0.55) RXRARXRBNOTUMCTRCALOX15
SCHEMBL18604547 0.86 DHODH (0.67) RXRARXRBDHODHKMOEGFR
SCHEMBL4246903 0.86 DHODH (0.67) RXRARXRBDHODHKMOEGFR
SCHEMBL2041424 0.84 TSHR (0.85) RXRARXRBCTRCALOX15TSHR
SCHEMBL15120764 0.84 EGFR (0.67) RXRARXRBTSHRSRD5A2DHODH
SCHEMBL15814719 0.84 DHODH (0.69) RXRARXRBAURKATPX2DHODH
SCHEMBL16488615 0.84 DHODH (0.69) RXRARXRBAURKATPX2DHODH

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 10 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
EP-1847524-B1 Terphenyl derivatives for treatment of Alzheimer's disease CELLZOME LTD (GB) 2009-10-14 EP 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
EP-2016039-B1 TERPHENYL DERIVATIVES FOR TREATMENT OF ALZHEIMER' S DISEASE ORTHO MCNEIL JANSSEN PHARM (US) 2012-08-01 EP disclosed
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 1179/4885RXRB 1173/4885NOTUM 370/4885

“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.