SCHEMBL9105019

SCHEMBL9105019

COc1ccc2c(N)c3c(nc2c1)C1CCC3C1

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACHE P22303 10/20 0.66
BCHE P06276 5/20 0.60
APP P05067 1/20 0.44
MPO P05164 1/20 0.43
NOS1 P29475 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
CHRM1 P11229 1/20 0.38
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37

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
SCHEMBL9106869 0.92 ACHE (0.54) ACHEBCHEAPPMPONOS1
SCHEMBL9107496 0.82 ACHE (0.71) ACHEBCHENOS1GRIN1GRIN2A
SCHEMBL9104297 0.80 ACHE (0.71) ACHEBCHEMPO
SCHEMBL9107842 0.80 ACHE (1.00) ACHEBCHENOS1CHRM1
SCHEMBL9586175 0.79 ACHE (0.49) ACHEBCHEAPPMPONPSR1
SCHEMBL9106773 0.76 ACHE (0.66) ACHEBCHE
SCHEMBL9106523 0.76 ACHE (1.00) ACHEBCHEKDM4EALDH1A1GLA
SCHEMBL9108456 0.75 TACR3 (0.51) ACHEBCHEALDH1A1
Hydrochloric Acid SCHEMBL10656143 0.75 ACHE (0.97) ACHEBCHEKDM4EALDH1A1GLA
SCHEMBL9107818 0.74 ACHE (0.71) ACHEBCHEKDM4EGRIN1GRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4897400-A ENHANCING MEMORY HOESCHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1990-01-30 US claimed
US-5401749-A Memory enhancers, cholinergic agents HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1995-03-28 US disclosed
EP-0278499-B1 9-Amino-1,4-ethano-1,2,3,4-tetrahydroacridine and related compounds, intermediates and a process for the preparation thereof and their use as medicaments HOECHST ROUSSEL PHARMA (US) 1994-09-28 EP disclosed
US-4897400-A ENHANCING MEMORY HOESCHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1990-01-30 US disclosed
EP-0278499-A2 9-Amino-1,4-ethano-1,2,3,4-tetrahydroacridine and related compounds, intermediates and a process for the preparation thereof and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1988-08-17 EP disclosed