SCHEMBL9107725

SCHEMBL9107725

Clc1ccc2nc3c(c(NCc4ccccc4)c2c1)C1CCC3C1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACHE P22303 5/20 0.58
BCHE P06276 1/20 0.44
HTR3A P46098 1/20 0.43
HRH4 Q9H3N8 1/20 0.43
TYMS P04818 1/20 0.43
FABP4 P15090 1/20 0.42
FABP5 Q01469 1/20 0.42
PDE5A O76074 4/20 0.42
PKM P14618 1/20 0.41
POLB P06746 1/20 0.41
RAD52 P43351 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL9109035 0.93 ACHE (0.48) ACHEHTR3AHRH4TYMSFABP4
SCHEMBL9108166 0.86 KMT2A (0.57) ACHEBCHEPDE5APOLBRAD52
SCHEMBL9108799 0.81 ACHE (0.55) ACHEBCHEPOLBRAD52KMT2A
SCHEMBL9106547 0.81 ACHE (0.66) ACHEBCHEHTR3AHRH4FABP4
SCHEMBL9352687 0.80 RAB9A (0.44) ACHEPKMPOLBKMT2A
SCHEMBL9107713 0.78 ACHE (0.41) ACHEBCHEPOLBRAD52KMT2A
SCHEMBL9108456 0.78 TACR3 (0.51) ACHEBCHE
SCHEMBL9103472 0.78 KMT2A (0.60) ACHEBCHEPDE5APKMPOLB
SCHEMBL10848116 0.75
SCHEMBL9108831 0.74 ACHE (0.60) ACHEBCHEFABP4FABP5

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