SCHEMBL4673753

SCHEMBL4673753

NC(=O)c1ccc2cc(OCc3nnn[nH]3)ccc2c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 10/20 0.43
LCK P06239 1/20 0.41
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
CHEK2 O96017 3/20 0.39
F2 P00734 1/20 0.39
HPGDS O60760 1/20 0.39
CFD P00746 1/20 0.38
MAOB P27338 2/20 0.38
PARP15 Q460N3 2/20 0.38
PARP14 Q460N5 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
SCHEMBL3060047 0.86 PARP1 (0.47) PARP10F2MAOBPARP15PARP14
SCHEMBL4672855 0.80 NCEH1 (0.38) NPC1MAPT
SCHEMBL4674381 0.79 NOS1 (0.41) NPC1MAPTF2MAOB
SCHEMBL4670519 0.78 PLAU (0.41) PARP10MAPTCHEK2HPGDS
SCHEMBL4673486 0.77 MET (0.39) CHEK2CFD
SCHEMBL8423888 0.77 MAOB (0.51) MAPTMAOB
SCHEMBL4675458 0.76 NPC1 (0.39) NPC1MAPTF2MAOB
SCHEMBL4675730 0.76 CHEK2 (0.37) MAPTCHEK2
SCHEMBL4670260 0.76 CHEK2 (0.38) PARP10CHEK2
SCHEMBL7394041 0.75 GSK3B (0.40) PARP10NPC1MAPTMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1397341-B1 6-(ARYL-AMIDO OR ARYL-AMIDOMETHYL)-NAPHTHALEN-2-YLOXY-ACIDIC DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR TYPE-1 (PAI-1) WYETH CORP (US) 2008-08-06 EP claimed
EP-1397341-A1 6-(ARYL-AMIDO OR ARYL-AMIDOMETHYL)-NAPHTHALEN-2-YLOXY-ACIDIC DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR TYPE-1 (PAI-1) Wyeth (US) 2004-03-17 EP claimed
US-6589970-B2 This invention provides novel compounds, pharmaceutical compositions and methods of treating thrombotic disorders in mammals, the compounds having the formula: WYETH 2003-07-08 US claimed
US-20030045560-A1 6-(Aryl-amido or aryl-amidomethyl)-naphthalen-2-yloxy-acidic derivatives as inhibitors of plasminogen activator inhibitor type-1 (PAI-1) WYETH 2003-03-06 US claimed
WO-2003000649-A1 6-(ARYL-AMIDO OR ARYL-AMIDOMETHYL)-NAPHTHALEN-2-YLOXY-ACIDIC DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR TYPE-1 (PAI-1) WYETH (US) 2003-01-03 WO claimed

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-20030045560-A1 6-(Aryl-amido or aryl-amidomethyl)-naphthalen-2-yloxy-acidic derivatives as inhibitors of plasminogen activator inhibitor type-1 (PAI-1) SERPINC1, F11, SERPINE1 PARP10 1656/4885LCK 4537/4885NPC1 451/4885

“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.