SCHEMBL2226530

SCHEMBL2226530

O=C(O)C1CCCN1C(=O)c1cccnc1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.66
CA2 P00918 1/20 0.53
VNN1 O95497 1/20 0.52
ACE P12821 2/20 0.51
DPP4 P27487 1/20 0.50
PREP P48147 1/20 0.50
FAP Q12884 1/20 0.50
DPP8 Q6V1X1 1/20 0.50
DPP9 Q86TI2 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL4893223 1.00 ALDH1A1 (0.66) ALDH1A1CA2VNN1ACEDPP4
SCHEMBL7592715 0.96 ALDH1A1 (0.61) ALDH1A1CA2VNN1ACEL3MBTL1
SCHEMBL10770319 0.88 ALDH1A1 (0.51) ALDH1A1VNN1DPP4PREPFAP
SCHEMBL10770322 0.88 ALDH1A1 (0.51) ALDH1A1VNN1DPP4PREPFAP
SCHEMBL6860849 0.86 ALDH1A1 (0.50) ALDH1A1CA2VNN1ACEDPP4
SCHEMBL10153787 0.84 VNN1 (0.51) ALDH1A1VNN1DPP4PREPFAP
SCHEMBL2226633 0.84 MMP2 (0.52) ALDH1A1VNN1DPP4PREPFAP
SCHEMBL13229 0.84 CA2 (0.67) ALDH1A1CA2L3MBTL1
SCHEMBL13230 0.84 CA2 (0.67) ALDH1A1CA2L3MBTL1
SCHEMBL28789388 0.84 CA2 (0.67) ALDH1A1CA2L3MBTL1

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
US-9464053-B2 Compositions for reducing Aβ 42 production and their use in treating alzheimer's disease (AD) KAREUS THERAPEUTICS, SA (CH) 2016-10-11 US disclosed
US-9464053-B2 Compositions for reducing Aβ 42 production and their use in treating alzheimer's disease (AD) KAREUS THERAPEUTICS, SA (CH) 2016-10-11 US disclosed
US-9464053-B2 Compositions for reducing Aβ 42 production and their use in treating alzheimer's disease (AD) KAREUS THERAPEUTICS, SA (CH) 2016-10-11 US disclosed
US-20140364457-A1 COMPOSITIONS FOR REDUCING AB 42 PRODUCTION AND THEIR USE IN TREATING ALZHEIMER'S DISEASE (AD) KAREUS THERAPEUTICS, SA (CH) 2014-12-11 US disclosed
US-20140364457-A1 COMPOSITIONS FOR REDUCING AB 42 PRODUCTION AND THEIR USE IN TREATING ALZHEIMER'S DISEASE (AD) KAREUS THERAPEUTICS, SA (CH) 2014-12-11 US disclosed
US-20140364457-A1 COMPOSITIONS FOR REDUCING AB 42 PRODUCTION AND THEIR USE IN TREATING ALZHEIMER'S DISEASE (AD) KAREUS THERAPEUTICS, SA (CH) 2014-12-11 US disclosed
US-8846721-B2 Compositions for reducing aβ 42 production and their use in treating alzheimer's disease (AD) KAREUS THERAPEUTICS SA (CH) 2014-09-30 US disclosed
US-8846721-B2 Compositions for reducing aβ 42 production and their use in treating alzheimer's disease (AD) KAREUS THERAPEUTICS SA (CH) 2014-09-30 US disclosed
US-8846721-B2 Compositions for reducing aβ 42 production and their use in treating alzheimer's disease (AD) KAREUS THERAPEUTICS SA (CH) 2014-09-30 US disclosed
US-20120322831-A1 COMPOSITIONS FOR REDUCING AB 42 PRODUCTION AND THEIR USE IN TREATING ALZHEIMER'S DISEASE (AD) KAREUS THERAPEUTICS SA (CH) 2012-12-20 US disclosed
US-20120322831-A1 COMPOSITIONS FOR REDUCING AB 42 PRODUCTION AND THEIR USE IN TREATING ALZHEIMER'S DISEASE (AD) KAREUS THERAPEUTICS SA (CH) 2012-12-20 US disclosed
US-20120322831-A1 COMPOSITIONS FOR REDUCING AB 42 PRODUCTION AND THEIR USE IN TREATING ALZHEIMER'S DISEASE (AD) KAREUS THERAPEUTICS SA (CH) 2012-12-20 US disclosed
EP-2528898-A2 NOVEL COMPOSITIONS FOR REDUCING Aß 42 PRODUCTION AND THEIR USE IN TREATING ALZHEIMER'S DISEASE (AD) Kareus Therapeutics SA (FR) 2012-12-05 EP disclosed
WO-2011089576-A2 NOVEL COMPOSITIONS FOR REDUCING Aß 42 PRODUCTION AND THEIR USE IN TREATING ALZHEIMER'S DISEASE (AD) KAREUS THERAPEUTTICS SA (CH) 2011-07-28 WO disclosed
WO-2011089576-A2 NOVEL COMPOSITIONS FOR REDUCING Aß 42 PRODUCTION AND THEIR USE IN TREATING ALZHEIMER'S DISEASE (AD) KAREUS THERAPEUTTICS SA (CH) 2011-07-28 WO disclosed
US-20080200512-A1 Hepatitis C virus polymerase inhibitors BLANEY JEFFREY MARK 2008-08-21 US disclosed
US-6194426-B1 CONTROLLING TUMOR NECROSIS FACTOR RHONA-POULENC RORER S.A. (FR) 2001-02-27 US disclosed
WO-1998025612-A1 NOVEL THERAPEUTIC APPLICATION OF PYRROLE DERIVATIVES RHONE-POULENC RORER S.A. (FR) 1998-06-18 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-20080200512-A1 Hepatitis C virus polymerase inhibitors SSU72, POLR2H, POLR2E ALDH1A1 276/4885CA2 1113/4885VNN1 3849/4885
US-20140364457-A1 COMPOSITIONS FOR REDUCING AB 42 PRODUCTION AND THEIR USE IN TREATING ALZHEIMER'S DISEASE (AD) PSEN2, APP, PSEN1 ALDH1A1 2084/4885CA2 3679/4885VNN1 2173/4885
US-20120322831-A1 COMPOSITIONS FOR REDUCING AB 42 PRODUCTION AND THEIR USE IN TREATING ALZHEIMER'S DISEASE (AD) PSEN2, APP, PSEN1 ALDH1A1 2084/4885CA2 3679/4885VNN1 2173/4885

“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.