SCHEMBL165582

SCHEMBL165582

CC(C)(C)OC(=O)N1CCN(c2cccc3c2CCC3N)CC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
SMARCA2 P51531 1/20 0.43
SMARCA4 P51532 1/20 0.43
PBRM1 Q86U86 1/20 0.43
KDM1A O60341 1/20 0.43
ACHE P22303 1/20 0.43
DDB1 Q16531 1/20 0.42
CRBN Q96SW2 1/20 0.42
TP53 P04637 1/20 0.41
THRB P10828 1/20 0.41
BACE1 P56817 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
SCHEMBL14591361 0.81 KDM1A (0.47) GPR119ALDH1A1LMNAMAPTSMARCA2
SCHEMBL14591362 0.81 KDM1A (0.47) GPR119ALDH1A1LMNAMAPTSMARCA2
SCHEMBL21995746 0.78 NAMPT (0.50) GPR119ALDH1A1LMNAMAPTSMARCA2
SCHEMBL1134857 0.77 GPR119 (0.45) GPR119ALDH1A1LMNAMAPTDDB1
SCHEMBL1855743 0.77 ADRA2C (0.46) LMNAMAPTACHE
SCHEMBL5357355 0.77 GPR119 (0.46) GPR119ALDH1A1LMNAMAPTKDM1A
SCHEMBL13749317 0.77 UCHL1 (0.49) GPR119ALDH1A1LMNAMAPTSMARCA2
SCHEMBL4222227 0.76 GPR119 (0.45) GPR119ALDH1A1LMNAMAPTSMARCA2
SCHEMBL25003310 0.76 HTR1A (0.49) GPR119ALDH1A1LMNAMAPTSMARCA2
SCHEMBL30885784 0.76 HTR1A (0.49) GPR119ALDH1A1LMNAMAPTSMARCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130252957-A1 PYRIDINONE ANTAGONISTS OF ALPHA-4 INTEGRINS ELAN PHARMACEUTICALS, INC. (US) 2013-09-26 US disclosed
US-20130252957-A1 PYRIDINONE ANTAGONISTS OF ALPHA-4 INTEGRINS ELAN PHARMACEUTICALS, INC. (US) 2013-09-26 US disclosed
US-20130252957-A1 PYRIDINONE ANTAGONISTS OF ALPHA-4 INTEGRINS ELAN PHARMACEUTICALS, INC. (US) 2013-09-26 US disclosed
US-8367836-B2 Pyridinone antagonists of alpha-4 integrins ELAN PHARMACEUTICALS, INC. (US) 2013-02-05 US disclosed
US-8367836-B2 Pyridinone antagonists of alpha-4 integrins ELAN PHARMACEUTICALS, INC. (US) 2013-02-05 US disclosed
US-8367836-B2 Pyridinone antagonists of alpha-4 integrins ELAN PHARMACEUTICALS, INC. (US) 2013-02-05 US disclosed
CN-102459179-A Pyridinone antagonists of alpha-4 integrins ELAN PHARM INC 2012-05-16 CN disclosed
EP-2424841-A1 PYRIDINONE ANTAGONISTS OF ALPHA-4 INTEGRINS Elan Pharmaceuticals Inc. (US) 2012-03-07 EP disclosed
US-20110009407-A1 PYRIDINONE ANTAGONISTS OF ALPHA-4 INTEGRINS ELAN PHARMACEUTICALS, INC. 2011-01-13 US disclosed
US-20110009407-A1 PYRIDINONE ANTAGONISTS OF ALPHA-4 INTEGRINS ELAN PHARMACEUTICALS, INC. 2011-01-13 US disclosed
US-20110009407-A1 PYRIDINONE ANTAGONISTS OF ALPHA-4 INTEGRINS ELAN PHARMACEUTICALS, INC. 2011-01-13 US disclosed
WO-2010126914-A1 PYRIDINONE ANTAGONISTS OF ALPHA-4 INTEGRINS ELAN PHARMACEUTICALS, INC. (US) 2010-11-04 WO disclosed
WO-2010126914-A1 PYRIDINONE ANTAGONISTS OF ALPHA-4 INTEGRINS ELAN PHARMACEUTICALS, INC. (US) 2010-11-04 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-20130252957-A1 PYRIDINONE ANTAGONISTS OF ALPHA-4 INTEGRINS ITGA4, ITGB4, ITGB5 GPR119 1237/4885ALDH1A1 829/4885LMNA 1423/4885
US-20110009407-A1 PYRIDINONE ANTAGONISTS OF ALPHA-4 INTEGRINS ITGA4, ITGB4, ITGB5 GPR119 1237/4885ALDH1A1 829/4885LMNA 1423/4885

“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.