SCHEMBL7663603

SCHEMBL7663603

O=C(O)N1CCC(CCc2c[nH]cn2)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.36
TEAD1 P28347 1/20 0.34
TEAD3 Q99594 1/20 0.34
GRIN2B Q13224 2/20 0.34
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2C Q14957 1/20 0.34
GRIN3A Q8TCU5 1/20 0.34
FAAH O00519 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ITGB3 P05106 1/20 0.32
ITGB1 P05556 1/20 0.32
ITGAV P06756 1/20 0.32
ITGB5 P18084 1/20 0.32

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
SCHEMBL7440324 0.77 ALDH1A1 (0.39) KDM4EALDH1A1TSHR
SCHEMBL8524329 0.76 HRH4 (0.41) HRH3GAATSHRIDO1
SCHEMBL6353897 0.74 HRH3 (0.49) HRH3FAAHITGB3
SCHEMBL7452641 0.74 DRD2 (0.37) SMN1; SMN2
SCHEMBL7449469 0.74 ALDH1A1 (0.38) KDM4EALDH1A1GAATSHRSMN1; SMN2
SCHEMBL7501670 0.73 LMNA (0.40)
SCHEMBL7451579 0.72 DRD2 (0.41) GAA
SCHEMBL2144796 0.70 BACE1 (0.39) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8670678 0.70 MAOA (0.55) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL24535634 0.69 CHRM4 (0.39) KDM4EALDH1A1ITGB3ITGAVITGB5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6498255-B2 CHOLINESTERASE INHIBITORS; COGNITION ACTIVATORS; ALZHEIMER'S DISEASE; E.G., 3-(2-(1-(PHENYLMETHYL)-4-PIPERIDINYL)ETHYL)-1,2-BENZISOXAZOLE PFIZER INC. 2002-12-24 US disclosed
US-6326382-B1 CHOLINESTERASE INHIBITORS; USEFUL IN ENHANCING MEMORY IN PATIENTS SUFFERING FROM DEMENTIA AND ALZHEIMER'S DISEASE EISAI CO., LTD (JP) 2001-12-04 US disclosed
EP-0646115-A1 HETEROCYCLIC-CYCLIC AMINE DERIVATIVES Eisai Co., Ltd. (JP) 1995-04-05 EP disclosed
WO-1992017475-A1 HETEROCYCLIC-CYCLIC AMINE DERIVATIVES PFIZER INC. (US) 1992-10-15 WO disclosed