SCHEMBL3972664

SCHEMBL3972664

CCCCc1oc2ccccc2c1C(=O)Nc1ccc(-c2ccc(OCC(=O)O)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 5/20 0.70
SIRT3 Q9NTG7 10/20 0.66
THRA P10827 1/20 0.55
THRB P10828 1/20 0.55
NR1H4 Q96RI1 1/20 0.53
KDM5A P29375 1/20 0.51
KDM7A Q6ZMT4 1/20 0.51
EYA3 Q99504 1/20 0.47

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
SCHEMBL4670483 0.89 SIRT3 (0.61) PTPN1SIRT3THRATHRBNR1H4
SCHEMBL4672800 0.88 SIRT3 (0.61) PTPN1SIRT3THRATHRBNR1H4
SCHEMBL4672788 0.88 SIRT3 (0.61) PTPN1SIRT3THRATHRBNR1H4
SCHEMBL3968618 0.87 SIRT3 (0.57) PTPN1SIRT3NR1H4KDM5AKDM7A
SCHEMBL3972255 0.85 PTPN1 (0.55) PTPN1SIRT3NR1H4KDM5AKDM7A
SCHEMBL3973517 0.85 PTPN1 (0.66) PTPN1SIRT3THRATHRBNR1H4
SCHEMBL5987451 0.85 SIRT3 (0.54) PTPN1SIRT3NR1H4KDM5AKDM7A
SCHEMBL31314642 0.84 SIRT3 (0.64) PTPN1SIRT3THRATHRBNR1H4
SCHEMBL7496233 0.83 PTPN1 (1.00) PTPN1SIRT3THRATHRBNR1H4
SCHEMBL5983412 0.82 PTPN1 (0.73) PTPN1SIRT3

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
US-7534894-B2 Biphenyloxy-acids WYETH (US) 2009-05-19 US claimed
EP-1667959-A1 BIPHENYLOXY-ACIDS Wyeth (US) 2006-06-14 EP claimed
US-20060020003-A1 Biphenyloxy-acids WYETH (US) 2006-01-26 US claimed
WO-2005030702-A1 BIPHENYLOXY-ACIDS WYETH (US) 2005-04-07 WO claimed
US-7534894-B2 Biphenyloxy-acids WYETH (US) 2009-05-19 US disclosed
EP-1667959-A1 BIPHENYLOXY-ACIDS Wyeth (US) 2006-06-14 EP disclosed
US-20060020003-A1 Biphenyloxy-acids WYETH (US) 2006-01-26 US disclosed
WO-2005030702-A1 BIPHENYLOXY-ACIDS WYETH (US) 2005-04-07 WO 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-20060020003-A1 Biphenyloxy-acids AHR, ARNT, NR1H4 PTPN1 1495/4885SIRT3 2700/4885THRA 788/4885

“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.