SCHEMBL6579567

SCHEMBL6579567

CCCCCc1c(-c2ccc3c(Br)c(O)ccc3c2)oc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 6/20 0.61
HSD17B1 P14061 1/20 0.43
HSD17B2 P37059 1/20 0.43
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
ALOX5 P09917 6/20 0.40

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
SCHEMBL6581607 0.87 PTPN1 (0.51) PTPN1HSD17B1HSD17B2ESR1ESR2
SCHEMBL6581606 0.87 PTPN1 (0.48) PTPN1HSD17B1HSD17B2ESR1ESR2
SCHEMBL6582140 0.83 PTPN1 (0.57) PTPN1ESR1ESR2
SCHEMBL6582980 0.82 PTPN1 (0.66) PTPN1
SCHEMBL6579756 0.81 PTPN1 (0.49) PTPN1
SCHEMBL6580387 0.81 PTPN1 (0.51) PTPN1HSD17B1HSD17B2ESR1ESR2
SCHEMBL6581972 0.81 PTPN1 (0.46) PTPN1HSD17B1HSD17B2ESR1ESR2
SCHEMBL6583913 0.80 PTPN1 (0.55) PTPN1
SCHEMBL6585300 0.80 ESR1 (0.54) PTPN1HSD17B1HSD17B2ESR1ESR2
SCHEMBL6585145 0.78 CNR1 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1401822-A1 NAPHTHYL BENZOFURAN DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) Wyeth (US) 2004-03-31 EP disclosed
US-6599925-B2 Cardiovascular disorders; anticancer agents WYETH 2003-07-29 US disclosed
US-20030018067-A1 Substituted naphthyl benzofuran derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) WYETH 2003-01-23 US disclosed
WO-2003000671-A1 NAPHTHYL BENZOFURAN DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) WYETH (US) 2003-01-03 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-20030018067-A1 Substituted naphthyl benzofuran derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) F2R, SERPINE1, SERPINC1 PTPN1 1287/4885HSD17B1 668/4885HSD17B2 1128/4885

“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.