SCHEMBL4898108

SCHEMBL4898108

Cc1c(C(=O)O)ccc(=O)n1-c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 15/20 0.62
ALDH1A1 P00352 1/20 0.62
MYC P01106 3/20 0.50
NR4A1 P22736 1/20 0.47
PLK1 P53350 1/20 0.44

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
SCHEMBL11454219 0.88 NOTUM (0.63) NOTUMALDH1A1MYCNR4A1
SCHEMBL3673624 0.86 ALDH1A1 (0.48) NOTUMALDH1A1MYCNR4A1
SCHEMBL11456565 0.85 NOTUM (0.65) NOTUMALDH1A1MYCNR4A1
SCHEMBL11456949 0.83 MEN1 (0.52) NOTUMALDH1A1MYCPLK1
SCHEMBL11458707 0.80 ALDH1A1 (0.48) NOTUMALDH1A1
SCHEMBL11455602 0.79 NOTUM (0.73) NOTUMALDH1A1
SCHEMBL11457533 0.78 NOTUM (0.69) NOTUMALDH1A1MYCNR4A1
SCHEMBL11463934 0.77 MYC (0.56) NOTUMALDH1A1MYCNR4A1
SCHEMBL3132883 0.76 NOTUM (1.00) NOTUMALDH1A1
SCHEMBL680769 0.75 ALDH1A1 (0.57) NOTUMALDH1A1MYCNR4A1

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
EP-3096758-A1 SUBSTITUTED N-ARYL PYRIDINONES Auspex Pharmaceuticals, Inc. (US) 2016-11-30 EP disclosed
US-9504677-B2 Substituted N-aryl pyridinones AUSPEX PHARMACEUTICALS, INC. (US) 2016-11-29 US disclosed
US-20160331734-A1 SUBSTITUTED N-ARYL PYRIDINONES AUSPEX PHARMACEUTICALS, INC. 2016-11-17 US disclosed
US-20150250777-A1 SUBSTITUTED N-ARYL PYRIDINONES PURETECH LYT 100, INC. 2015-09-10 US disclosed
WO-2015112701-A1 SUBSTITUTED N-ARYL PYRIDINONES AUSPEX PHARMACEUTICALS, INC. (US) 2015-07-30 WO disclosed
US-9062001-B2 Substituted N-aryl pyridinones AUSPEX PHARMACEUTICALS, INC. (US) 2015-06-23 US disclosed
US-20150126562-A1 SUBSTITUTED N-ARYL PYRIDONES AUSPEX PHARMACEUTICALS, INC. 2015-05-07 US disclosed
US-9018232-B2 Substituted N-aryl pyridinones AUSPEX PHARMACEUTICALS, INC. (US) 2015-04-28 US disclosed
US-8969575-B2 Substituted N-Aryl pyridinones AUSPEX PHARMACEUTICALS, INC. (US) 2015-03-03 US disclosed
US-8969576-B2 Substituted N-aryl pyridinones AUSPEX PHARMACEUTICALS, INC. (US) 2015-03-03 US disclosed
US-20140348928-A1 SUBSTITUTED N-ARYL PYRIDINONES PURETECH LYT 100, INC. 2014-11-27 US disclosed
US-20140235677-A1 SUBSTITUTED N-ARYL PYRIDINONES AUSPEX PHARMACEUTICALS, INC. (US) 2014-08-21 US disclosed
US-20140107040-A1 SUBSTITUTED N-ARYL PYRIDINONES AUSPEX PHARMACEUTICALS, INC. (US) 2014-04-17 US disclosed
US-8680123-B1 Substituted N-aryl pyridinones AUSPEX PHARMACEUTICALS, INC (US) 2014-03-25 US disclosed
US-20130345264-A1 SUBSTITUTED N-ARYL PYRIDONES AUSPEX PHARMACEUTICALS 2013-12-26 US disclosed
US-8383823-B2 Substituted N-aryl pyridinones AUSPEX PHARMACEUTICALS (US) 2013-02-26 US disclosed
EP-2170828-B1 SUBSTITUTED N-ARYL PYRIDINONES AS FIBROTIC INHIBITORS AUSPEX PHARMACEUTICALS INC (US) 2012-11-21 EP disclosed
US-20080319026-A1 SUBSTITUTED N-ARYL PYRIDINONES AUSPEX PHARMACEUTICALS, INC. (US) 2008-12-25 US 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 (8 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-20140107040-A1 SUBSTITUTED N-ARYL PYRIDINONES COL1A1, COL2A1, COLGALT1 NOTUM 4252/4885ALDH1A1 293/4885MYC 3612/4885
US-20140348928-A1 SUBSTITUTED N-ARYL PYRIDINONES COL1A1, COL2A1, COLGALT1 NOTUM 4252/4885ALDH1A1 293/4885MYC 3612/4885
US-20140235677-A1 SUBSTITUTED N-ARYL PYRIDINONES COL1A1, COL2A1, COLGALT1 NOTUM 4252/4885ALDH1A1 293/4885MYC 3612/4885
US-20150126562-A1 SUBSTITUTED N-ARYL PYRIDONES PIR, PDXK, PDGFRB NOTUM 4274/4885ALDH1A1 108/4885MYC 1432/4885
US-20130345264-A1 SUBSTITUTED N-ARYL PYRIDONES PIR, PDXK, PDGFRB NOTUM 4274/4885ALDH1A1 108/4885MYC 1432/4885
US-20080319026-A1 SUBSTITUTED N-ARYL PYRIDINONES COL1A1, COL2A1, COLGALT1 NOTUM 4252/4885ALDH1A1 293/4885MYC 3612/4885
US-20160331734-A1 SUBSTITUTED N-ARYL PYRIDINONES COL1A1, COL2A1, COLGALT1 NOTUM 4256/4885ALDH1A1 329/4885MYC 3391/4885
US-20150250777-A1 SUBSTITUTED N-ARYL PYRIDINONES COL1A1, COL2A1, COLGALT1 NOTUM 4252/4885ALDH1A1 293/4885MYC 3612/4885

“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.