SCHEMBL5107271

SCHEMBL5107271

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

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOD2 Q9HC29 1/20 0.43
NOD1 Q9Y239 1/20 0.43
CCR2 P41597 1/20 0.41
ALOX5AP P20292 2/20 0.39
TP53 P04637 1/20 0.39
ICMT O60725 2/20 0.39
SERPINE1 P05121 1/20 0.39
GPR35 Q9HC97 1/20 0.38
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
PTGES2 Q9H7Z7 1/20 0.38
PPARG P37231 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37

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
SCHEMBL5097240 0.83 TP53 (0.44) NOD2NOD1CCR2TP53ICMT
SCHEMBL4940384 0.83 MMP12 (0.44) NOD2NOD1ALOX5APSERPINE1PPARG
SCHEMBL5100318 0.80 NOD2 (0.70) NOD2NOD1CCR2GPR35MEN1
SCHEMBL5097220 0.79 SRD5A2 (0.50) NOD2NOD1ALOX5APMEN1KMT2A
SCHEMBL5100158 0.76 SERPINE1 (0.47) ICMTSERPINE1GAAPTGES2PPARG
SCHEMBL4944885 0.76 SERPINE1 (0.50) CCR2ALOX5APSERPINE1GAAPPARG
SCHEMBL5100347 0.74 ALDH1A1 (0.46) CCR2GPR35GAAPPARG
SCHEMBL5093653 0.70 CCR9 (0.55) CCR2TP53SERPINE1MEN1KMT2A
SCHEMBL5100813 0.69 SERPINE1 (0.59) TP53ICMTSERPINE1PTGES2PPARG
SCHEMBL5100968 0.69 SRD5A2 (0.47) ALOX5APTP53MEN1KMT2APPARG

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 NOD2 3379/4885NOD1 880/4885CCR2 734/4885
US-20060270728-A1 Substituted dihydropyrano indole-3,4-dione derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) SERPINE1, TFPI, F2 NOD2 3636/4885NOD1 947/4885CCR2 751/4885

“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.