SCHEMBL3973525

SCHEMBL3973525

CCCCc1oc2ccccc2c1C(=O)NCc1ccc(-c2ccc(OC(C)C(=O)O)c(Br)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 12/20 0.48
TTR P02766 1/20 0.47
SIRT3 Q9NTG7 3/20 0.43
NR1H4 Q96RI1 1/20 0.42
PTGS2 P35354 1/20 0.42
EYA3 Q99504 1/20 0.41

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
SCHEMBL3971361 0.87 PTPN1 (0.54) PTPN1TTRSIRT3NR1H4EYA3
SCHEMBL3978636 0.86 PTPN1 (0.47) PTPN1TTRNR1H4EYA3
SCHEMBL5987315 0.80 PTPN1 (0.59) PTPN1TTRSIRT3
SCHEMBL3978232 0.77 PTPN1 (0.61) PTPN1TTR
SCHEMBL3972255 0.76 PTPN1 (0.55) PTPN1TTRSIRT3NR1H4EYA3
SCHEMBL3973756 0.75 TTR (0.49) PTPN1TTRSIRT3NR1H4EYA3
SCHEMBL4672732 0.75 PTPN1 (0.78) PTPN1TTRSIRT3NR1H4EYA3
SCHEMBL3971675 0.75 PTPN1 (0.53) PTPN1TTRNR1H4
SCHEMBL3974141 0.74 TTR (0.50) PTPN1TTRSIRT3NR1H4EYA3
SCHEMBL4670488 0.73 PTPN1 (0.73) PTPN1TTRSIRT3NR1H4EYA3

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
US-7534894-B2 Biphenyloxy-acids WYETH (US) 2009-05-19 US disclosed
US-20060020003-A1 Biphenyloxy-acids WYETH (US) 2006-01-26 US 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 1495/4885TTR 2868/4885SIRT3 2700/4885

“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.