SCHEMBL5437310

SCHEMBL5437310

O=C(O)c1c(-c2ccccc2)c2ccccc2n1Cc1ccc(NS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 6/20 0.79
MAPK8 P45983 4/20 0.55
EDNRB P24530 2/20 0.49
EDNRA P25101 2/20 0.49
LMNA P02545 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
KDM4E B2RXH2 1/20 0.47
USP2 O75604 1/20 0.47
ALDH1A1 P00352 1/20 0.47
POLB P06746 1/20 0.47
HDAC1 Q13547 3/20 0.46
HDAC8 Q9BY41 2/20 0.46
PPARG P37231 1/20 0.46
PSMD14 O00487 1/20 0.46
HDAC6 Q9UBN7 1/20 0.45
CCR2 P41597 1/20 0.45
HDAC4 P56524 1/20 0.45

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
SCHEMBL4892537 0.89 SERPINE1 (1.00) SERPINE1MAPK8EDNRBEDNRAMEN1
SCHEMBL5424000 0.88 SERPINE1 (0.62) SERPINE1MAPK8EDNRBEDNRALMNA
SCHEMBL5417724 0.86 SERPINE1 (0.60) SERPINE1MAPK8EDNRBEDNRALMNA
SCHEMBL4887004 0.84 SERPINE1 (1.00) SERPINE1MAPK8EDNRBEDNRAMEN1
SCHEMBL5419800 0.84 SERPINE1 (0.66) SERPINE1MAPK8EDNRBEDNRALMNA
SCHEMBL4893854 0.80 SERPINE1 (1.00) SERPINE1MAPK8MEN1KMT2AALDH1A1
SCHEMBL4884146 0.77 SERPINE1 (1.00) SERPINE1MAPK8EDNRBEDNRAHDAC1
SCHEMBL4884301 0.77 SERPINE1 (0.80) SERPINE1MAPK8EDNRBEDNRACCR2
SCHEMBL5426724 0.76 EDNRB (0.52) SERPINE1MAPK8EDNRBEDNRALMNA
SCHEMBL4892523 0.76 SERPINE1 (0.73) SERPINE1MAPK8EDNRBEDNRAHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070299125-A1 Substituted indoles WYETH (US) 2007-12-27 US claimed
US-7268159-B2 Substituted indoles WYETH (US) 2007-09-11 US claimed
EP-1670758-A1 SUBSTITUTED INDOLE ACID DERIVATIVES AND THEIR USE AS PAI-1 INHIBITORS Wyeth (US) 2006-06-21 EP claimed
US-20050113438-A1 Substituted indoles WYETH (US) 2005-05-26 US claimed
WO-2005030717-A1 SUBSTITUTED INDOLE ACID DERIVATIVES AND THEIR USE AS PAI-1 INHIBITORS WYETH (US) 2005-04-07 WO claimed
US-20070299125-A1 Substituted indoles WYETH (US) 2007-12-27 US disclosed
US-7268159-B2 Substituted indoles WYETH (US) 2007-09-11 US disclosed
EP-1670758-A1 SUBSTITUTED INDOLE ACID DERIVATIVES AND THEIR USE AS PAI-1 INHIBITORS Wyeth (US) 2006-06-21 EP disclosed
US-20050113438-A1 Substituted indoles WYETH (US) 2005-05-26 US disclosed
WO-2005030717-A1 SUBSTITUTED INDOLE ACID DERIVATIVES AND THEIR USE AS PAI-1 INHIBITORS WYETH (US) 2005-04-07 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-20070299125-A1 Substituted indoles IDO2, IDO1, INMT SERPINE1 4834/4885MAPK8 3676/4885EDNRB 1106/4885
US-20050113438-A1 Substituted indoles IDO2, IDO1, INMT SERPINE1 4834/4885MAPK8 3676/4885EDNRB 1106/4885

“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.