SCHEMBL293463

SCHEMBL293463

O=C1[CH]CCCc2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.55
MAOB P27338 3/20 0.55
CYP2A6 P11509 1/20 0.55
CES1 P23141 2/20 0.50
NOS3 P29474 1/20 0.44
PDPK1 O15530 1/20 0.42
PARP1 P09874 1/20 0.42
PARP10 Q53GL7 1/20 0.42
PARP11 Q9NR21 1/20 0.42
TSHR P16473 1/20 0.42
MAPT P10636 3/20 0.42
MIF P14174 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
HPGD P15428 1/20 0.41
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38
NFKB1 P19838 1/20 0.38
RAB9A P51151 1/20 0.38
NFKB2 Q00653 1/20 0.38

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
SCHEMBL30252319 0.80 MAOA (0.52) MAOAMAOBCYP2A6CES1NOS3
SCHEMBL268687 0.75 CYP2A6 (0.45) MAOAMAOBCYP2A6CES1NOS3
SCHEMBL57446 0.73 MAOA (0.46) MAOAMAOBCYP2A6CES1PDPK1
SCHEMBL11144928 0.73 CES1 (0.73) MAOAMAOBCYP2A6CES1PDPK1
SCHEMBL31430380 0.71 TSHR (0.71) MAOAMAOBCYP2A6CES1NOS3
SCHEMBL3103992 0.71 CYP2A6 (0.68) MAOAMAOBCYP2A6CES1NOS3
SCHEMBL568779 0.71 TSHR (0.71) MAOAMAOBCYP2A6CES1NOS3
SCHEMBL30505637 0.71 CYP2A6 (0.68) MAOAMAOBCYP2A6CES1NOS3
SCHEMBL44545 0.71 MAOA (1.00) MAOAMAOBCYP2A6CES1PDPK1
SCHEMBL18607288 0.71 MAOA (0.91) MAOAMAOBCYP2A6CES1NOS3

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 160 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110053981-A1 Methods and Compositions Using Cholinesterase Inhibitors EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-03-03 US claimed
EP-2140868-A1 Use of a cholinesterase inhibitor for the treatment of dementia and cognitive impairments associated with or caused by chemotherapy Eisai R&D Management Co., Ltd. (JP) 2010-01-06 EP claimed
EP-2138177-A1 Use of a cholinesterase inhibitor for the treatment of dementia and cognitive impairments Eisai R&D Management Co., Ltd. (JP) 2009-12-30 EP claimed
EP-2133078-A1 Use of a cholinesterase inhibitor for the treatment of dementia and cognitive impairments Eisai R&D Management Co., Ltd. (JP) 2009-12-16 EP claimed
EP-2130538-A1 Use of a cholinesterase inhibitor for the delaying the onset of Alzheimer's disease Eisai R&D Management Co., Ltd. (JP) 2009-12-09 EP claimed
US-20080312189-A1 Cadasil Treatment with Cholinesterase Inhibitors EISAI CO., LTD. (JP) 2008-12-18 US claimed
EP-1729761-A4 CADASIL TREATMENT WITH CHOLINESTERASE INHIBITORS EISAI CO LTD (JP) 2008-09-03 EP claimed
EP-1764101-A1 Use of a cholinesterase inhibitor for the treatment of dementia and cognitive impairments Eisai R&D Management Co., Ltd. (JP) 2007-03-21 EP claimed
EP-1729761-A1 CADASIL TREATMENT WITH CHOLINESTERASE INHIBITORS Eisai Co., Ltd. (JP) 2006-12-13 EP claimed
EP-1311272-B1 NOVEL METHODS USING CHOLINESTERASE INHIBITORS EISAI CO LTD (JP) 2006-11-22 EP claimed
EP-1311272-A1 NOVEL METHODS USING CHOLINESTERASE INHIBITORS Eisai Co., Ltd. (JP) 2003-05-21 EP claimed
EP-1311272-A4 NOVEL METHODS USING CHOLINESTERASE INHIBITORS EISAI CO LTD (JP) 2003-05-21 EP claimed
US-20020052373-A1 Combination treatment for dementia or cognitive deficits associated with alzheimer's disease and parkinson's disease ZORN STEVIN H (US) 2002-05-02 US claimed
EP-1201268-A2 Combinations of D4 dopamine receptor antagonists with acetylcholine esterase inhibitors Pfizer Products Inc. (US) 2002-05-02 EP claimed
WO-2001066114-A1 NOVEL METHODS USING CHOLINESTERASE INHIBITORS EISAI CO., LTD. (JP) 2001-09-13 WO claimed
EP-1116716-A1 Piperidine and piperazine compounds for use in the treatment of Alzheimer Eisai Co., Ltd. (JP) 2001-07-18 EP claimed
EP-0742207-A1 2-(Indan-1-one-2-yl-alkyl)-1-phenylalkyl-piperidines and processes for their preparation Eisai Co., Ltd. (JP) 1996-11-13 EP claimed
EP-0673927-A1 4-[2-indanyl-1-one]alkylpiperidines as anticholinergic agents Eisai Co., Ltd. (JP) 1995-09-27 EP claimed
US-5100901-A Treatment of Alzheimer*s disease EISAI CO., LTD. (JP) 1992-03-31 US claimed
EP-0296560-A2 1,4-Substituted piperidines as acetylcholinesterase inhibitors and their use for the treatment of Alzheimer's disease Eisai Co., Ltd. (JP) 1988-12-28 EP claimed

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-20020052373-A1 Combination treatment for dementia or cognitive deficits associated with alzheimer's disease and parkinson's disease ACHE, BCHE, CHRM4 MAOA 43/4885MAOB 60/4885CYP2A6 1457/4885
US-20080312189-A1 Cadasil Treatment with Cholinesterase Inhibitors NOTCH3, NOTCH2, NOTCH4 MAOA 1116/4885MAOB 1644/4885CYP2A6 2425/4885
US-20110053981-A1 Methods and Compositions Using Cholinesterase Inhibitors PSEN1, BACE1, PSENEN MAOA 1099/4885MAOB 1097/4885CYP2A6 4053/4885

“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.