SCHEMBL9255949

SCHEMBL9255949

c1ccc(CNc2c3c(nc4ccc(C5CCCCC5)cc24)CCCC3)cc1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.67
KDM4E B2RXH2 1/20 0.61
MEN1 O00255 1/20 0.61
HTT P42858 1/20 0.61
KMT2A Q03164 1/20 0.61
BCHE P06276 9/20 0.60
BACE1 P56817 1/20 0.60
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52

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
Hydrochloric Acid SCHEMBL9257222 0.99 ACHE (0.66) ACHEKDM4EMEN1HTTKMT2A
SCHEMBL9257175 0.99 ACHE (0.69) ACHEKDM4EMEN1HTTKMT2A
SCHEMBL9260517 0.96 ACHE (0.70) ACHEKDM4EMEN1HTTKMT2A
SCHEMBL9261331 0.93 ACHE (0.68) ACHEKDM4EMEN1HTTKMT2A
SCHEMBL9257288 0.92 ACHE (0.68) ACHEKDM4EMEN1HTTKMT2A
SCHEMBL9261203 0.88 ACHE (0.71) ACHEKDM4EMEN1HTTKMT2A
SCHEMBL9253349 0.87 ACHE (0.58) ACHEKDM4EMEN1HTTKMT2A
SCHEMBL9257365 0.85 ACHE (0.61) ACHEBCHE
SCHEMBL9255970 0.83 ACHE (0.63) ACHEBCHE
SCHEMBL9252705 0.83 ACHE (0.65) ACHEMEN1HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5391553-A Increasing cholinergic functionin mammals HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1995-02-21 US claimed
US-5391553-A Increasing cholinergic functionin mammals HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1995-02-21 US disclosed
EP-0282959-A2 Substituted 9-amino-tetrahydro-acridines and related compounds, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1988-09-21 EP disclosed