SCHEMBL5097357

SCHEMBL5097357

CC(=O)OCc1cc2cc(-c3cccc(C)c3)ccc2n1Cc1ccc(C(C)(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 4/20 0.50
CCR9 P51686 5/20 0.44
ALOX5AP P20292 2/20 0.40
TP53 P04637 1/20 0.40
ICMT O60725 2/20 0.39
PTGES2 Q9H7Z7 1/20 0.39
CCR2 P41597 1/20 0.38
MDM2 Q00987 1/20 0.38
PPARG P37231 1/20 0.38

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
SCHEMBL5107271 0.91 NOD2 (0.43) SERPINE1ALOX5APTP53ICMTPTGES2
SCHEMBL5093653 0.81 CCR9 (0.55) SERPINE1CCR9TP53CCR2
SCHEMBL5100968 0.79 SRD5A2 (0.47) CCR9ALOX5APTP53PPARG
SCHEMBL5100813 0.78 SERPINE1 (0.59) SERPINE1CCR9TP53ICMTPTGES2
SCHEMBL4940384 0.77 MMP12 (0.44) SERPINE1ALOX5APPPARG
SCHEMBL5097240 0.74 TP53 (0.44) SERPINE1TP53ICMTCCR2PPARG
SCHEMBL4944885 0.74 SERPINE1 (0.50) SERPINE1ALOX5APCCR2PPARG
SCHEMBL5100318 0.72 NOD2 (0.70) CCR2
SCHEMBL4022763 0.71 SERPINE1 (0.57) SERPINE1CCR9ICMTPPARG
SCHEMBL5097220 0.71 SRD5A2 (0.50) ALOX5APPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7459478-B2 Substituted dihydropyrano indole-3,4-dione derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) WYETH (US) 2008-12-02 US disclosed
US-20060270728-A1 Substituted dihydropyrano indole-3,4-dione derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) WYETH (US) 2006-11-30 US disclosed
US-7101903-B2 Substituted dihydropyrano indole-3,4-dione derivatives as inhibitiors of plasminogen activator inhibitor-1 (PAI-1) WYETH (US) 2006-09-05 US disclosed
EP-1569639-A2 SUBSTITUTED DIHYDROPYRANO INDOLE-3,4-DIONE DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) Wyeth (US) 2005-09-07 EP disclosed
US-20050113436-A1 9-(4-Methylbenzyl)-6-[4-(trifluoromethoxy)phenyl]-1,9-dihydropyrano[3,4-b]indole-3,4-dione; treating fibrinolytic disorders, vein thrombosis and coronary heart disease, and pulmonary fibrosis WYETH (US) 2005-05-26 US disclosed
WO-2004052893-A2 SUBSTITUTED DIHYDROPYRANO INDOLE-3,4-DIONE DERIVATIVES AND 3-OXOACETIC ACID SUBSTITUTED 2-HYDROXYMETHYLINDOLE DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) WYETH (US) 2004-06-24 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 (2 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-20050113436-A1 9-(4-Methylbenzyl)-6-[4-(trifluoromethoxy)phenyl]-1,9-dihydropyrano[3,4-b]indole-3,4-dione; treating fibrinolytic disorders, vein thrombosis and coronary heart disease, and pulmonary fibrosis FGB, SERPINE1, MMP1 SERPINE1 2/4885CCR9 694/4885ALOX5AP 1014/4885
US-20060270728-A1 Substituted dihydropyrano indole-3,4-dione derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) SERPINE1, TFPI, F2 SERPINE1 1/4885CCR9 1859/4885ALOX5AP 786/4885

“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.