SCHEMBL292135

SCHEMBL292135

C[CH]CC(CCN)CCCCC

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
LMNA P02545 1/20 0.40
OPRM1 P35372 1/20 0.38
DNM1 Q05193 8/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TSHR P16473 1/20 0.37
EPHX1 P07099 1/20 0.37
SPHK1 Q9NYA1 1/20 0.36
CYP3A4 P08684 1/20 0.35

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
SCHEMBL293174 0.94 ALDH1A1 (0.46) ALDH1A1TDP1LMNADNM1MEN1
SCHEMBL27836473 0.89 LMNA (0.48) ALDH1A1TDP1LMNAOPRM1DNM1
SCHEMBL27942319 0.87 LMNA (0.52) ALDH1A1TDP1LMNAOPRM1DNM1
SCHEMBL27953209 0.87 LMNA (0.46) ALDH1A1TDP1LMNAOPRM1DNM1
SCHEMBL27953206 0.87 LMNA (0.52) ALDH1A1TDP1LMNAOPRM1DNM1
SCHEMBL27953219 0.87 LMNA (0.52) ALDH1A1TDP1LMNAOPRM1DNM1
SCHEMBL27942253 0.85 LMNA (0.50) ALDH1A1TDP1LMNAOPRM1DNM1
SCHEMBL27942243 0.85 LMNA (0.50) ALDH1A1TDP1LMNAOPRM1DNM1
SCHEMBL293419 0.85 CA12 (0.30) ALDH1A1TDP1
SCHEMBL28100081 0.85 LMNA (0.50) ALDH1A1TDP1LMNAOPRM1DNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2086538-B1 COMBINATION THERAPIES FOR TREATING ALZHEIMER'S DISEASE USING DIMEBON AND DONEPEZIL MEDIVATION NEUROLOGY INC (US) 2012-03-14 EP disclosed
EP-2420235-A1 Methods and combination therapies for treating alzheimer's disease Medivation Neurology, Inc. (US) 2012-02-22 EP disclosed
WO-2010095041-A2 COMPOSITIONS, METHODS, AND KITS FOR TREATING INFLUENZA VIRAL INFECTIONS EXCRX (SINGAPORE) PTE.LTD. (SG) 2010-08-26 WO disclosed
US-20100152108-A1 METHODS AND COMBINATION THERAPIES FOR TREATING ALZHEIMER'S DISEASE MEDIVATION NEUROLOGY, INC. (US) 2010-06-17 US disclosed
US-20100130537-A1 CINNAMIDE COMPOUNDS FOR DEMENTIA EISAI R&D MANAGEMENT CO., LTD (JP) 2010-05-27 US disclosed
US-20100099714-A1 AMPA and NMDA Receptor Antagonists for Neurodegenerative Diseases EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-04-22 US disclosed
EP-2148673-A1 CINNAMIDE COMPOUNDS FOR DEMENTIA Eisai R&D Management Co., Ltd. (JP) 2010-02-03 EP disclosed
EP-2131828-A2 AMPA AND NMDA RECEPTOR ANTAGONISTS FOR NEURODEGENERATIVE DISEASES Eisai R&D Management Co., Ltd. (JP) 2009-12-16 EP disclosed
EP-2086538-A2 COMBINATION THERAPIES FOR TREATING ALZHEIMER'S DISEASE USING I.A. DIMEBON AND DOLEPEZIL Medivation Neurology, Inc. (US) 2009-08-12 EP disclosed
WO-2008139984-A1 CINNAMIDE COMPOUNDS FOR DEMENTIA EISAI R & D MANAGEMENT CO., LTD. (JP) 2008-11-20 WO disclosed
WO-2008111590-A2 AMPA AND NMDA RECEPTOR ANTAGONISTS FOR NEURODEGENERATIVE DISEASES EISAI R & D MANAGEMENT CO., LTD. (JP) 2008-09-18 WO disclosed
WO-2008051599-A2 COMBINATION THERAPIES FOR TREATING ALZHEIMER'S DISEASE USING I. A. DIMEBON AND DOLEPEZIL MEDIVATION NEUROLOGY, INC. (US) 2008-05-02 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-20100130537-A1 CINNAMIDE COMPOUNDS FOR DEMENTIA GRIN1, GRIN2A, GRIN3A ALDH1A1 1878/4885TDP1 2369/4885LMNA 2715/4885
US-20100099714-A1 AMPA and NMDA Receptor Antagonists for Neurodegenerative Diseases GRIN1, GRIN2A, GRIN3A ALDH1A1 3296/4885TDP1 280/4885LMNA 3472/4885
US-20100152108-A1 METHODS AND COMBINATION THERAPIES FOR TREATING ALZHEIMER'S DISEASE PSEN2, APP, PSEN1 ALDH1A1 1605/4885TDP1 1536/4885LMNA 3427/4885

“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.