SCHEMBL9107818

SCHEMBL9107818

Cc1ccc2nc3c(c(N)c2c1)C1CCC3C1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACHE P22303 10/20 0.71
BCHE P06276 7/20 0.65
GRIN1 Q05586 4/20 0.46
GRIN2A Q12879 4/20 0.46
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
NCOA1 Q15788 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HIF1A Q16665 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
KDM4E B2RXH2 1/20 0.39
RAD52 P43351 1/20 0.39

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
SCHEMBL9106864 0.91 ACHE (0.58) ACHEBCHEGRIN1GRIN2ALMNA
SCHEMBL9107496 0.89 ACHE (0.71) ACHEBCHEGRIN1GRIN2A
SCHEMBL9584001 0.83 ACHE (1.00) ACHEBCHEGRIN1GRIN2A
SCHEMBL9105519 0.81 ACHE (0.47) ACHEBCHELMNAPOLBSMN1; SMN2
SCHEMBL10532976 0.80 ACHE (0.66) ACHEBCHE
SCHEMBL9106523 0.79 ACHE (1.00) ACHEBCHESMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL10656143 0.78 ACHE (0.97) ACHEBCHELMNAPOLBHTT
SCHEMBL9105577 0.77 ACHE (0.52) ACHEBCHEPOLBHTTSMN1; SMN2
SCHEMBL9107842 0.74 ACHE (1.00) ACHEBCHE
SCHEMBL9104297 0.74 ACHE (0.71) ACHEBCHE

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-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
US-4897400-A ENHANCING MEMORY HOESCHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1990-01-30 US disclosed