SCHEMBL676833

SCHEMBL676833

Cc1cc2c(cc1C)C(=O)NC(C)C2

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.56
HTT P42858 1/20 0.46
MKNK1 Q9BUB5 1/20 0.43
CDC7 O00311 2/20 0.40
CREBBP Q92793 5/20 0.37
BRD4 O60885 4/20 0.37
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PIM1 P11309 3/20 0.33
PIM2 Q9P1W9 2/20 0.33
AR P10275 2/20 0.33
NNMT P40261 2/20 0.33
PGR P06401 1/20 0.33
ACHE P22303 1/20 0.33

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
SCHEMBL8360444 0.80 TSHR (0.54) TSHRMKNK1CDC7CREBBPBRD4
SCHEMBL11746648 0.74 TSHR (0.40) TSHRCREBBPBRD4LMNAGAA
SCHEMBL3308170 0.74 TSHR (0.60) TSHRMKNK1CDC7BRD4LMNA
SCHEMBL21333673 0.74 TSHR (0.60) TSHRMKNK1CDC7LMNAACHE
SCHEMBL30285537 0.74 TSHR (0.60) TSHRMKNK1CDC7LMNAACHE
SCHEMBL14991244 0.74 TSHR (0.60) TSHRMKNK1CDC7PIM1
SCHEMBL14991559 0.74 TSHR (0.60) TSHRMKNK1CDC7PIM1
SCHEMBL21470711 0.74 TSHR (0.60) TSHRMKNK1CDC7CREBBPBRD4
SCHEMBL2170999 0.74 TSHR (0.60) TSHRMKNK1CDC7BRD4LMNA
SCHEMBL14991246 0.74 TSHR (0.60) TSHRMKNK1CDC7PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160271108-A1 METHODS AND COMPOSITIONS FOR IMPROVING COGNITIVE FUNCTION AGENEBIO, INC. 2016-09-22 US disclosed
US-20110212928-A1 METHODS AND COMPOSITIONS FOR IMPROVING COGNITIVE FUNCTION THE JOHNS HOPKINS UNIVERSITY (US) 2011-09-01 US disclosed
US-20110053981-A1 Methods and Compositions Using Cholinesterase Inhibitors EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-03-03 US disclosed
US-20100168174-A1 Combination of AMPA Receptor Antagonists and Acetylcholinesterase Inhibitors for the Treatment of Neuropathic Pain EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-07-01 US disclosed
US-20100130537-A1 CINNAMIDE COMPOUNDS FOR DEMENTIA EISAI R&D MANAGEMENT CO., LTD (JP) 2010-05-27 US disclosed
US-7563808-B2 Methods for treating cognitive impairments or dementia EISAI CO., LTD. (JP) 2009-07-21 US disclosed
US-20090131480-A1 Dihydropyridine Compounds for Neurodegenerative Diseases and Dementia EISAI CO., LTD. (JP) 2009-05-21 US disclosed
US-20090042939-A1 Methods and Compositions Using Cholinesterase Inhibitors EISAI CO., LTD. (JP) 2009-02-12 US disclosed
US-20090042940-A1 METHODS AND COMPOSITIONS USING CHOLINESTERASE INHIBITORS EISAI CO., LTD. (JP) 2009-02-12 US disclosed
US-20080312189-A1 Cadasil Treatment with Cholinesterase Inhibitors EISAI CO., LTD. (JP) 2008-12-18 US disclosed
US-20080167343-A1 Methods and compositions using cholinesterase inhibitors EISAI CO., LTD. (JP) 2008-07-10 US disclosed
US-20080045500-A1 Nerve Regeneration Stimulator EISAI R&D MANAGEMENT CO., LTD. (JP) 2008-02-21 US disclosed
US-20070129402-A1 Donepezil; pharmacokinetics; single-dose administration of the formulation to a patient provides a blood plasma level profile with a dosage-corrected Cmax EISAI RESEARCH INSTITUTE (US) 2007-06-07 US disclosed
US-20070021397-A1 Neurocyte protective agent EISAI CO., LTD. (JP) 2007-01-25 US disclosed
US-20060172992-A1 Therapeutic agent for overactive bladder resulting from cerebral infarction EISAI CO., LTD. (JP) 2006-08-03 US disclosed
US-20060135507-A1 Therapeutic agent for overactive bladder involved in aging EISAI R & D MANAGEMENT CO., LTD. (JP) 2006-06-22 US 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 (15 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 TSHR 4157/4885HTT 937/4885MKNK1 2413/4885
US-20080167343-A1 Methods and compositions using cholinesterase inhibitors PSEN1, BACE1, PSENEN TSHR 253/4885HTT 406/4885MKNK1 226/4885
US-20100168174-A1 Combination of AMPA Receptor Antagonists and Acetylcholinesterase Inhibitors for the Treatment of Neuropathic Pain ACHE, CHRNA5, CHRNA2 TSHR 1994/4885HTT 4182/4885MKNK1 2426/4885
US-20070021397-A1 Neurocyte protective agent CHAT, GAP43, NES TSHR 4607/4885HTT 277/4885MKNK1 3505/4885
US-20090131480-A1 Dihydropyridine Compounds for Neurodegenerative Diseases and Dementia CHRNA5, GRIN1, GRIK5 TSHR 2819/4885HTT 20/4885MKNK1 3142/4885
US-20080045500-A1 Nerve Regeneration Stimulator ACHE, NGF, GAP43 TSHR 1772/4885HTT 4109/4885MKNK1 3260/4885
US-20160271108-A1 METHODS AND COMPOSITIONS FOR IMPROVING COGNITIVE FUNCTION BACE2, BACE1, GRIN2A TSHR 1591/4885HTT 352/4885MKNK1 2282/4885
US-20060135507-A1 Therapeutic agent for overactive bladder involved in aging ACHE, BPHL, GLA TSHR 3517/4885HTT 2142/4885MKNK1 4335/4885
US-20070129402-A1 Donepezil; pharmacokinetics; single-dose administration of the formulation to a patient provides a blood plasma level profile with a dosage-corrected Cmax CYP3A5, SLC6A2, SLC6A4 TSHR 2784/4885HTT 506/4885MKNK1 4247/4885
US-20090042939-A1 Methods and Compositions Using Cholinesterase Inhibitors PSEN1, BACE1, PSENEN TSHR 253/4885HTT 406/4885MKNK1 226/4885
US-20060172992-A1 Therapeutic agent for overactive bladder resulting from cerebral infarction ACHE, CHAT, BCHE TSHR 3098/4885HTT 3218/4885MKNK1 2876/4885
US-20080312189-A1 Cadasil Treatment with Cholinesterase Inhibitors NOTCH3, NOTCH2, NOTCH4 TSHR 4830/4885HTT 1399/4885MKNK1 3613/4885
US-20110053981-A1 Methods and Compositions Using Cholinesterase Inhibitors PSEN1, BACE1, PSENEN TSHR 253/4885HTT 406/4885MKNK1 226/4885
US-20110212928-A1 METHODS AND COMPOSITIONS FOR IMPROVING COGNITIVE FUNCTION BACE1, BACE2, ACHE TSHR 4373/4885HTT 954/4885MKNK1 2271/4885
US-20090042940-A1 METHODS AND COMPOSITIONS USING CHOLINESTERASE INHIBITORS PSEN1, BACE1, PSENEN TSHR 253/4885HTT 406/4885MKNK1 226/4885

“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.