SCHEMBL1795433

SCHEMBL1795433

CCNCCOc1ccc2c(c1)C(=O)c1ccc(OCCNCC)cc1-2

nearest known ligand 0.94

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.56
KMT2A Q03164 3/20 0.56
CHRNA7 P36544 1/20 0.56
L3MBTL1 Q9Y468 2/20 0.55
MEN1 O00255 1/20 0.55
NPC1 O15118 1/20 0.55
ALDH1A1 P00352 1/20 0.55
GAA P10253 1/20 0.55
RAB9A P51151 1/20 0.55
POLB P06746 1/20 0.51
DNMT1 P26358 1/20 0.51
RAD52 P43351 1/20 0.51
TERT O14746 1/20 0.41
PTPN1 P18031 1/20 0.40
ADRB2 P07550 1/20 0.40

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
SCHEMBL1797579 0.97 MAPT (0.51) MAPTKMT2ACHRNA7L3MBTL1MEN1
SCHEMBL11852462 0.97 MAPT (0.55) MAPTKMT2ACHRNA7L3MBTL1MEN1
SCHEMBL11842903 0.97 MAPT (0.55) MAPTKMT2ACHRNA7L3MBTL1MEN1
SCHEMBL1797837 0.97 MAPT (0.59) MAPTKMT2ACHRNA7L3MBTL1MEN1
SCHEMBL1797929 0.95 MAPT (0.57) MAPTKMT2ACHRNA7L3MBTL1MEN1
SCHEMBL1796882 0.92 MAPT (0.52) MAPTKMT2ACHRNA7L3MBTL1MEN1
SCHEMBL1795384 0.92 MAPT (0.60) MAPTKMT2ACHRNA7L3MBTL1MEN1
SCHEMBL1796640 0.90 MAPT (0.57) MAPTKMT2ACHRNA7L3MBTL1MEN1
SCHEMBL1797456 0.86 MAPT (0.52) MAPTKMT2ACHRNA7L3MBTL1MEN1
SCHEMBL1795330 0.86 MAPT (0.60) MAPTKMT2ACHRNA7L3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2258682-A2 Amino-substituted tricyclic derivatives and methods of use Abbott Laboratories (US) 2010-12-08 EP claimed
US-20080161281-A1 Amino-Substituted Tricyclic Derivatives and Methods of Use ABBOTT LABORATORIES (US) 2008-07-03 US claimed
US-20050234031-A1 Amino-substituted tricyclic derivatives and methods of use ABBVIE INC. 2005-10-20 US claimed
US-20050171079-A1 Amino-substituted tricyclic derivatives and methods of use SCHRIMPF MICHAEL R (US) 2005-08-04 US claimed
US-7951791-B2 e.g. 2,7-bis-[(3R)-1-azabicyclo[2.2.2]octan-3-yloxy]-fluoren-9-one; alpha 7 Nicotinic acetylcholine receptors ligands; cognitive disorder, neurodegeneration, and neurodevelopmental disorders ABBOTT LABORATORIES (US) 2011-05-31 US disclosed
EP-2258682-A2 Amino-substituted tricyclic derivatives and methods of use Abbott Laboratories (US) 2010-12-08 EP disclosed
US-20080161281-A1 Amino-Substituted Tricyclic Derivatives and Methods of Use ABBOTT LABORATORIES (US) 2008-07-03 US disclosed
US-7365193-B2 Amino-substituted tricyclic derivatives and methods of use ABBOTT LABORATORIES (US) 2008-04-29 US disclosed
US-20050234031-A1 Amino-substituted tricyclic derivatives and methods of use ABBVIE INC. 2005-10-20 US disclosed
US-20050171079-A1 Amino-substituted tricyclic derivatives and methods of use SCHRIMPF MICHAEL R (US) 2005-08-04 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 (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-20050234031-A1 Amino-substituted tricyclic derivatives and methods of use CHRNA1, CHRM1, GALR1 MAPT 3330/4885KMT2A 2287/4885CHRNA7 8/4885
US-20080161281-A1 Amino-Substituted Tricyclic Derivatives and Methods of Use CHRNA1, CHRM1, CHRNB1 MAPT 3318/4885KMT2A 2285/4885CHRNA7 5/4885
US-20050171079-A1 Amino-substituted tricyclic derivatives and methods of use CHRM1, CHRM3, CHRNA1 MAPT 2875/4885KMT2A 1700/4885CHRNA7 6/4885

“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.