SCHEMBL6582155

SCHEMBL6582155

Cc1c(OCC#N)ccc2cc(-c3cc4ccccc4o3)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.41
ALOX5 P09917 2/20 0.40
MAOB P27338 2/20 0.39
TNKS O95271 1/20 0.38
MAOA P21397 1/20 0.38
PTPRC P08575 1/20 0.38
PTPN1 P18031 1/20 0.38
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
GLA P06280 2/20 0.37
HPGD P15428 2/20 0.37
HSD17B10 Q99714 2/20 0.37
ALDH2 P05091 1/20 0.37
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.37
KMT2A Q03164 3/20 0.37
POLB P06746 1/20 0.37
MEN1 O00255 2/20 0.36

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
SCHEMBL6581425 0.87 ALOX5 (0.40) PTGESALOX5MAOBTNKSMAOA
SCHEMBL6582439 0.76 PTPN1 (0.39) ALOX5PTPN1MAPT
SCHEMBL6581742 0.73 TP53 (0.36) TNKSPTPN1KDM4EALDH1A1HPGD
SCHEMBL6579600 0.72 LMNA (0.42) TNKSPTPN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL4220001 0.72 ALOX5 (0.38) ALOX5MAOBTNKSMAOAPTPRC
SCHEMBL3331012 0.72 CYP19A1 (0.52) PTGESALOX5MAOBMAOAPTPRC
SCHEMBL6582051 0.72 TP53 (0.41) MAOBMAOAKDM4EALDH1A1SMN1; SMN2
SCHEMBL6582877 0.70 PPARG (0.41) MAOBTNKSPTPRCPTPN1KDM4E
SCHEMBL4209512 0.69 PDE4D (0.52) MAOBMAOAKDM4EL3MBTL1KMT2A
SCHEMBL6581873 0.69 KDM4E (0.48) TNKSKDM4EALDH1A1SMN1; SMN2GLA

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 PTGES 1646/4885ALOX5 238/4885MAOB 1411/4885

“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.