SCHEMBL2227252

SCHEMBL2227252

COC(=O)C(CC(C)C)NC(=O)c1cccnc1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 16/20 0.61
TAS1R1 Q7RTX1 16/20 0.61
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
LMNA P02545 1/20 0.52
SCN9A Q15858 1/20 0.51
ALDH1A1 P00352 1/20 0.50

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
SCHEMBL9828179 0.86 LMNA (0.57) MEN1KMT2ALMNASCN9A
SCHEMBL2228194 0.86 LMNA (0.57) MEN1KMT2ALMNASCN9A
SCHEMBL29809574 0.85 ECE1 (0.56) MEN1KMT2ALMNAALDH1A1
SCHEMBL10331461 0.85 ECE1 (0.56) MEN1KMT2ALMNAALDH1A1
SCHEMBL10407750 0.83 TAS1R3 (0.68) TAS1R3TAS1R1
SCHEMBL6241209 0.83 TAS1R3 (0.68) TAS1R3TAS1R1
SCHEMBL19588666 0.83 MEN1 (0.52) MEN1KMT2ALMNAALDH1A1
SCHEMBL6860349 0.82 ECE1 (0.62) MEN1KMT2ALMNAALDH1A1
SCHEMBL22460628 0.82 TAS1R3 (0.55) TAS1R3TAS1R1MEN1KMT2ALMNA
SCHEMBL6860711 0.82 KMT2A (0.51) MEN1KMT2ALMNAALDH1A1

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 15 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

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-20140364457-A1 COMPOSITIONS FOR REDUCING AB 42 PRODUCTION AND THEIR USE IN TREATING ALZHEIMER'S DISEASE (AD) PSEN2, APP, PSEN1 TAS1R3 4701/4885TAS1R1 4784/4885MEN1 4437/4885
US-20120322831-A1 COMPOSITIONS FOR REDUCING AB 42 PRODUCTION AND THEIR USE IN TREATING ALZHEIMER'S DISEASE (AD) PSEN2, APP, PSEN1 TAS1R3 4701/4885TAS1R1 4784/4885MEN1 4437/4885

“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.