SCHEMBL4940883

SCHEMBL4940883

CCOC(=O)C(=O)c1cn(Cc2ccccc2)c2cc(-c3ccc(C(F)(F)F)cc3)ccc12

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 9/20 0.61
L3MBTL1 Q9Y468 2/20 0.45
MAPK1 P28482 1/20 0.45
ICMT O60725 3/20 0.45
F2RL3 Q96RI0 1/20 0.44
ADORA1 P30542 1/20 0.43
SCN9A Q15858 1/20 0.42
P2RX3 P56373 1/20 0.42
CYP19A1 P11511 1/20 0.41

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
SCHEMBL4942794 0.92 SERPINE1 (0.61) SERPINE1L3MBTL1MAPK1ICMTF2RL3
SCHEMBL4949337 0.92 SERPINE1 (0.52) SERPINE1L3MBTL1MAPK1F2RL3ADORA1
SCHEMBL4943358 0.91 SERPINE1 (0.56) SERPINE1ICMTSCN9AP2RX3
SCHEMBL4943888 0.89 SERPINE1 (0.45) SERPINE1SCN9ACYP19A1
SCHEMBL3857317 0.89 SERPINE1 (0.79) SERPINE1L3MBTL1MAPK1ICMTF2RL3
SCHEMBL3859418 0.87 SERPINE1 (0.80) SERPINE1L3MBTL1MAPK1ICMTADORA1
SCHEMBL4946406 0.86 ICMT (0.60) SERPINE1L3MBTL1MAPK1ICMTF2RL3
SCHEMBL4941375 0.84 SERPINE1 (0.63) SERPINE1L3MBTL1ICMTF2RL3ADORA1
SCHEMBL5571633 0.83 SERPINE1 (0.66) SERPINE1L3MBTL1MAPK1ICMTF2RL3
SCHEMBL4939557 0.83 SERPINE1 (0.60) SERPINE1L3MBTL1ICMTF2RL3ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080214647-A1 SUBSTITUTED INDOLE ACID DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) WYETH (US) 2008-09-04 US disclosed
US-7368471-B2 Substituted indole acid derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) WYETH (US) 2008-05-06 US disclosed
EP-1844771-A2 Substituted indole acid derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) Wyeth (US) 2007-10-17 EP disclosed
EP-1397130-B1 SUBSTITUTED INDOLE ACID DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) WYETH CORP (US) 2007-07-25 EP disclosed
US-20060167059-A1 Substituted indole acid derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) WYETH (US) 2006-07-27 US disclosed
US-7074817-B2 Substituted indole acid derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) WYETH (US) 2006-07-11 US disclosed
EP-1397130-A1 SUBSTITUTED INDOLE ACID DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) Wyeth (US) 2004-03-17 EP disclosed
US-20030125371-A1 Substituted indole acid derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) WYETH 2003-07-03 US disclosed
WO-2003000253-A1 SUBSTITUTED INDOLE ACID 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 (3 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-20080214647-A1 SUBSTITUTED INDOLE ACID DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) SERPINE1, TFPI, F12 SERPINE1 1/4885L3MBTL1 1632/4885MAPK1 719/4885
US-20060167059-A1 Substituted indole acid derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) SERPINE1, TFPI, F12 SERPINE1 1/4885L3MBTL1 1623/4885MAPK1 727/4885
US-20030125371-A1 Substituted indole acid derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) TFPI, SERPINE1, PLAT SERPINE1 2/4885L3MBTL1 1512/4885MAPK1 749/4885

“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.