SCHEMBL4437515

SCHEMBL4437515

CCCCN1CCC(C(CC=O)c2cc(Cl)c(N)cc2OC)CC1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 12/20 0.54
ACHE P22303 3/20 0.54
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
TSHR P16473 1/20 0.54
KMT2A Q03164 1/20 0.54

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
SCHEMBL8604296 0.88 MEN1 (0.45) HTR4ACHEMEN1ALDH1A1CYP2D6
Hydrochloric Acid SCHEMBL8599115 0.87 MEN1 (0.45) HTR4ACHEMEN1ALDH1A1CYP2D6
Hydrochloric Acid SCHEMBL8603489 0.86 ABCB1 (0.46) HTR4ACHEMEN1ALDH1A1CYP2D6
SCHEMBL3237705 0.85 HTR4 (0.56) HTR4MEN1ALDH1A1CYP2D6CYP2C9
SCHEMBL27144286 0.84 ACHE (0.62) HTR4ACHE
SCHEMBL7259062 0.82 HTR4 (0.40) HTR4ACHEMEN1ALDH1A1CYP2D6
SCHEMBL3230374 0.82 HTR4 (0.61) HTR4ACHEMEN1ALDH1A1CYP2D6
Hydrochloric Acid SCHEMBL8971273 0.78 HTR4 (0.61) HTR4ACHEMEN1ALDH1A1CYP2D6
Hydrochloric Acid SCHEMBL8600089 0.78 MEN1 (0.45) HTR4MEN1ALDH1A1CYP2D6KMT2A
SCHEMBL8602267 0.75 MEN1 (0.62) HTR4MEN1ALDH1A1CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2076288-A2 COMBINATION COMPRISING AN HMG-COA REDUCTASE INHIBITOR AND A SECOND NEUROGENIC AGENT FOR TREATING A NERVOUS SYSTEM DISORDER AND INCREASING NEUROGENESIS Braincells, Inc. (US) 2009-07-08 EP disclosed
EP-1942879-A1 GABA RECEPTOR MEDIATED MODULATION OF NEUROGENESIS Braincells, Inc. (US) 2008-07-16 EP disclosed
EP-1937236-A2 MODULATION OF NEUROGENESIS BY HDAC INHIBITION Braincells, Inc. (US) 2008-07-02 EP disclosed
WO-2008036846-A2 COMBINATION COMPRISING AN HMG-COA REDUCTASE INHIBITOR AND A SECOND NEUROGENIC AGENT FOR TREATING A NERVOUS SYSTEM DISORDER AND INCREASING NEUROGENESIS BRAINCELLS, INC. (US) 2008-03-27 WO disclosed
WO-2007053596-A1 GABA RECEPTOR MEDIATED MODULATION OF NEUROGENESIS BRAINCELLS, INC. (US) 2007-05-10 WO disclosed
WO-2007030697-A2 MODULATION OF NEUROGENESIS BY HDAC INHIBITION BRAINCELLS, INC. (US) 2007-03-15 WO disclosed