SCHEMBL4982128

SCHEMBL4982128

Cc1cccc(Nc2ccc3c(c2)c(-c2ccccc2)c(C(=O)O)n3Cc2ccccc2)c1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 5/20 0.68
EDNRB P24530 3/20 0.48
EDNRA P25101 3/20 0.48
MAPK8 P45983 3/20 0.48
ALDH1A1 P00352 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
POLB P06746 1/20 0.43
ECE1 P42892 1/20 0.42
ELANE P08246 1/20 0.41
TP53 P04637 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
SCHEMBL27664461 0.88 SERPINE1 (0.66) SERPINE1EDNRBEDNRAMAPK8MEN1
SCHEMBL4980145 0.88 SERPINE1 (0.81) SERPINE1EDNRBEDNRAMAPK8MEN1
SCHEMBL4982359 0.84 SERPINE1 (0.92) SERPINE1EDNRBEDNRAMAPK8
SCHEMBL4980302 0.81 SERPINE1 (1.00) SERPINE1EDNRBEDNRA
SCHEMBL5419800 0.80 SERPINE1 (0.66) SERPINE1EDNRBEDNRAMAPK8ALDH1A1
SCHEMBL4986284 0.79 SERPINE1 (0.57) SERPINE1EDNRBEDNRAMAPK8POLB
SCHEMBL4884301 0.77 SERPINE1 (0.80) SERPINE1EDNRBEDNRAMAPK8
SCHEMBL14117729 0.77 SERPINE1 (0.56) SERPINE1EDNRBEDNRAMAPK8ALDH1A1
SCHEMBL4887004 0.76 SERPINE1 (1.00) SERPINE1EDNRBEDNRAMAPK8MEN1
SCHEMBL5174020 0.76 SERPINE1 (0.58) SERPINE1EDNRBEDNRAMAPK8POLB

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-7332521-B2 Substituted indoles WYETH (US) 2008-02-19 US claimed
JP-2007506772-A 2007-03-22 JP claimed
EP-1667970-A1 HETEROCYCLIC- OR ARYLOXY, -THIO 0R -AMINO SUBSTITUTED INDOLES-2-CARBOXYLIC ACIDS OR ESTERS AS PAI-1 INHIBITORS Wyeth (US) 2006-06-14 EP claimed
US-20050119327-A1 Substituted indoles WYETH (US) 2005-06-02 US claimed
WO-2005030716-A1 HETEROCYCLIC- OR ARYLOXY, -THIO OR -AMINO SUBSTITUTED INDOLES-2-CARBOXYLIC ACIDS OR ESTERS AS PAI-1 WYETH (US) 2005-04-07 WO claimed
US-7332521-B2 Substituted indoles WYETH (US) 2008-02-19 US disclosed
EP-1667970-A1 HETEROCYCLIC- OR ARYLOXY, -THIO 0R -AMINO SUBSTITUTED INDOLES-2-CARBOXYLIC ACIDS OR ESTERS AS PAI-1 INHIBITORS Wyeth (US) 2006-06-14 EP disclosed
US-20050119327-A1 Substituted indoles WYETH (US) 2005-06-02 US disclosed
WO-2005030716-A1 HETEROCYCLIC- OR ARYLOXY, -THIO OR -AMINO SUBSTITUTED INDOLES-2-CARBOXYLIC ACIDS OR ESTERS AS PAI-1 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 (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-20050119327-A1 Substituted indoles IDO2, IDO1, TPH2 SERPINE1 4772/4885EDNRB 895/4885EDNRA 518/4885

“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.