SCHEMBL5987315

SCHEMBL5987315

CCCCc1oc2ccccc2c1C(=O)CNCc1ccc(-c2ccc(OC(Cc3ccccc3)C(=O)O)c(Br)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 17/20 0.59
SIRT3 Q9NTG7 1/20 0.45
TTR P02766 1/20 0.43
PTPRF P10586 1/20 0.42
PTPRA P18433 1/20 0.42
PTPN7 P35236 1/20 0.42
DUSP3 P51452 1/20 0.42
PPARA Q07869 1/20 0.42

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
SCHEMBL4670491 0.86 PTPN1 (0.75) PTPN1SIRT3TTR
SCHEMBL3978232 0.85 PTPN1 (0.61) PTPN1TTRPTPRFPTPRAPTPN7
SCHEMBL3971675 0.80 PTPN1 (0.53) PTPN1TTR
SCHEMBL3973525 0.80 PTPN1 (0.48) PTPN1SIRT3TTR
SCHEMBL3971361 0.77 PTPN1 (0.54) PTPN1SIRT3TTR
SCHEMBL4672732 0.76 PTPN1 (0.78) PTPN1SIRT3TTR
SCHEMBL6336686 0.75 PTPN1 (0.70) PTPN1SIRT3TTRPTPRFPTPRA
SCHEMBL6336688 0.75 PTPN1 (0.70) PTPN1SIRT3TTRPTPRFPTPRA
SCHEMBL7506554 0.75 PTPN1 (1.00) PTPN1PTPRFPTPRAPTPN7DUSP3
SCHEMBL3978636 0.75 PTPN1 (0.47) PTPN1TTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1667959-A1 BIPHENYLOXY-ACIDS Wyeth (US) 2006-06-14 EP disclosed
WO-2005030702-A1 BIPHENYLOXY-ACIDS WYETH (US) 2005-04-07 WO disclosed