SCHEMBL4020524

SCHEMBL4020524

CCCCCCC(=O)c1ccc2cc(OC)ccc2c1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.67
CYP1A2 P05177 1/20 0.67
HPGD P15428 1/20 0.67
CYP2C19 P33261 1/20 0.67
HSD17B10 Q99714 1/20 0.67
THRA P10827 1/20 0.61
KDM4E B2RXH2 1/20 0.55
STS P08842 4/20 0.55
HSD17B3 P37058 6/20 0.54
HDAC8 Q9BY41 2/20 0.54
HDAC1 Q13547 2/20 0.54

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
SCHEMBL4083170 1.00 ALDH1A1 (0.67) ALDH1A1CYP1A2HPGDCYP2C19HSD17B10
SCHEMBL16672058 1.00 ALDH1A1 (0.67) ALDH1A1CYP1A2HPGDCYP2C19HSD17B10
SCHEMBL10574043 0.98 ALDH1A1 (0.68) ALDH1A1CYP1A2HPGDCYP2C19HSD17B10
SCHEMBL10415403 0.94 ALDH1A1 (0.70) ALDH1A1CYP1A2HPGDCYP2C19HSD17B10
SCHEMBL9805743 0.88 CYP1A2 (0.81) ALDH1A1CYP1A2HPGDCYP2C19HSD17B10
SCHEMBL9805821 0.88 CYP1A2 (0.81) ALDH1A1CYP1A2HPGDCYP2C19HSD17B10
SCHEMBL9805771 0.88 THRA (0.56) ALDH1A1CYP1A2HPGDCYP2C19HSD17B10
SCHEMBL11465372 0.88 CYP2C19 (0.74) ALDH1A1CYP1A2HPGDCYP2C19HSD17B10
SCHEMBL6344166 0.87 THRA (0.55) ALDH1A1CYP1A2HPGDCYP2C19HSD17B10
SCHEMBL6340900 0.87 THRA (0.55) ALDH1A1CYP1A2HPGDCYP2C19HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7629377-B2 Substituted naphthyl indole derivatives as inhibitors of plasminogen activator inhibitor type-1 (PAI-1) WYETH (US) 2009-12-08 US disclosed
EP-1397356-B1 SUBSTITUTED NAPHTHYL INDOLE DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR TYPE-1 (PAI-1) WYETH CORP (US) 2009-05-13 EP disclosed
US-20080182883-A1 SUBSTITUTED NAPHTHYL INDOLE DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR TYPE-1 (PAI-1) WYETH (US) 2008-07-31 US disclosed
US-7351730-B2 Substituted naphthyl indole derivatives as inhibitors of plasminogen activator inhibitor type-1 (PAI-1) WYETH (US) 2008-04-01 US disclosed
US-20080071091-A1 PROCESSES AND COMPOUNDS FOR THE PREPARATION OF SUBSTITUTED NAPHTHYLINDOLE DERIVATIVES WYETH (US) 2008-03-20 US disclosed
US-20080071091-A1 PROCESSES AND COMPOUNDS FOR THE PREPARATION OF SUBSTITUTED NAPHTHYLINDOLE DERIVATIVES WYETH (US) 2008-03-20 US disclosed
US-7323483-B2 Processes and compounds for the preparation of substituted naphthylindole derivatives WYETH (US) 2008-01-29 US disclosed
US-7323483-B2 Processes and compounds for the preparation of substituted naphthylindole derivatives WYETH (US) 2008-01-29 US disclosed
EP-1856104-A1 PROCESSES AND COMPOUNDS FOR THE PREPARATION OF SUBSTITUTED NAPHTHYLINDOLE DERIVATIVES Wyeth a Corporation of the State of Delaware (US) 2007-11-21 EP disclosed
US-20060183917-A1 Processes and compounds for the preparation of substituted naphthylindole derivatives WYETH (US) 2006-08-17 US disclosed
WO-2006081455-A1 PROCESSES AND COMPOUNDS FOR THE PREPARATION OF SUBSTITUTED NAPHTHYLINDOLE DERIVATIVES WYETH (US) 2006-08-03 WO disclosed
US-20060014725-A1 Substituted naphthyl indole derivatives as inhibitors of plasminogen activator inhibitor type-1 (PAI-1) WYETH (US) 2006-01-19 US disclosed
US-6939886-B2 Substituted naphthyl indole derivatives as inhibitors of plasminogen activator inhibitor Type-1 (PAI-1) WYETH (US) 2005-09-06 US disclosed
US-20040266733-A1 Substituted naphthyl indole derivatives as inhibitors of plasminogen activator inhibitor Type-1 (PAI-1) WYETH 2004-12-30 US disclosed
US-6800654-B2 FOR TREATING CONDITIONS RESULTING FROM FIBRINOLYTIC DISORDERS SUCH AS DEEP VEIN THROMBOSIS AND CORONARY HEART DISEASE, AND PULMONARY FIBROSIS. WYETH 2004-10-05 US disclosed
EP-1397356-A1 SUBSTITUTED NAPHTHYL INDOLE DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR TYPE-1 (PAI-1) Wyeth (US) 2004-03-17 EP disclosed
US-20030032626-A1 Substituted naphthyl indole derivatives as inhibitors of plasminogen activator inhibitor type-1 (PAI-1) WYETH 2003-02-13 US disclosed
WO-2003000684-A1 SUBSTITUTED NAPHTHYL INDOLE DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR TYPE-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 (6 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-20080071091-A1 PROCESSES AND COMPOUNDS FOR THE PREPARATION OF SUBSTITUTED NAPHTHYLINDOLE DERIVATIVES SERPINE1, SERPINB1, TFPI ALDH1A1 214/4885CYP1A2 43/4885HPGD 123/4885
US-20060014725-A1 Substituted naphthyl indole derivatives as inhibitors of plasminogen activator inhibitor type-1 (PAI-1) TFPI, SERPINE1, F12 ALDH1A1 871/4885CYP1A2 1235/4885HPGD 2039/4885
US-20060183917-A1 Processes and compounds for the preparation of substituted naphthylindole derivatives SERPINE1, SERPINB1, TFPI ALDH1A1 214/4885CYP1A2 43/4885HPGD 123/4885
US-20080182883-A1 SUBSTITUTED NAPHTHYL INDOLE DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR TYPE-1 (PAI-1) TFPI, SERPINE1, F12 ALDH1A1 897/4885CYP1A2 1282/4885HPGD 1899/4885
US-20030032626-A1 Substituted naphthyl indole derivatives as inhibitors of plasminogen activator inhibitor type-1 (PAI-1) TFPI, SERPINE1, SERPINC1 ALDH1A1 837/4885CYP1A2 1205/4885HPGD 1735/4885
US-20040266733-A1 Substituted naphthyl indole derivatives as inhibitors of plasminogen activator inhibitor Type-1 (PAI-1) TFPI, SERPINE1, SERPINC1 ALDH1A1 818/4885CYP1A2 1194/4885HPGD 1669/4885

“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.