SCHEMBL9105256

SCHEMBL9105256

CNc1c2c(nc3ccc(Cl)cc13)C1CCC2CC1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.54
FABP4 P15090 1/20 0.46
FABP5 Q01469 1/20 0.46
HTR3A P46098 6/20 0.42
HRH4 Q9H3N8 3/20 0.40
ALDH1A1 P00352 1/20 0.38
KDM1A O60341 1/20 0.36
MPO P05164 1/20 0.35
CYP1A2 P05177 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL9106547 0.92 ACHE (0.66) ACHEFABP4FABP5HTR3AHRH4
SCHEMBL9109989 0.84 KDM4E (0.39) ACHEALDH1A1KDM1A
SCHEMBL9109035 0.80 ACHE (0.48) ACHEFABP4FABP5HTR3AHRH4
SCHEMBL9106781 0.80 BCHE (0.50) ACHEALDH1A1KDM1ACYP1A2
SCHEMBL9355887 0.77 NPC1 (0.46) ACHEALDH1A1KDM1ATSHR
SCHEMBL9105519 0.77 ACHE (0.47) ACHEALDH1A1KDM1A
SCHEMBL9106918 0.74 ACHE (0.55) ACHEFABP4FABP5KDM1A
SCHEMBL10847217 0.73 CYP1A2 (0.47) ACHEALDH1A1CYP1A2TSHR
SCHEMBL9107725 0.73 ACHE (0.58) ACHEFABP4FABP5HTR3AHRH4
SCHEMBL9105665 0.71 ACHE (0.62) ACHEHTR3AKDM1ATSHR

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