SCHEMBL14106935

SCHEMBL14106935

C=C/C(=C\C=C/N)S(=O)(=O)n1ccc2ccc(N3CCNCC3)cc21

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
HTR6 P50406 17/20 0.40
HTR1A P08908 2/20 0.39
DRD2 P14416 2/20 0.39
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
HTR3A P46098 1/20 0.36
HTR5A P47898 1/20 0.36
HTR3D Q70Z44 1/20 0.36
HTR3C Q8WXA8 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
HTR2A P28223 1/20 0.34
HTR7 P34969 1/20 0.34
PIM1 P11309 1/20 0.32
PIM3 Q86V86 1/20 0.32

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
SCHEMBL5103907 0.69 HTR6 (0.77) HTR6HTR1ADRD2HTR2AHTR7
SCHEMBL14106926 0.69 ALDH1A1 (0.37) KDM4EALDH1A1LMNAHTR6
SCHEMBL14107093 0.69 HTR6 (0.46) HTR6HTR1ADRD2HTR2AHTR7
SCHEMBL14107050 0.66 HTR6 (0.56) HTR6HTR1ADRD2HTR3EHTR3B
SCHEMBL5095082 0.66 HTR6 (0.60) HTR6HTR1ADRD2HTR3EHTR3B
SCHEMBL5091061 0.66 HTR6 (0.64) HTR6HTR1ADRD2HTR3EHTR3B
SCHEMBL5095041 0.66 HTR6 (0.52) ALDH1A1LMNAHTR6HTR1ADRD2
SCHEMBL5091047 0.65 HTR6 (0.63) HTR6HTR1ADRD2HTR7
SCHEMBL14107044 0.65 HTR6 (0.60) HTR6HTR1ADRD2HTR2AHTR7
SCHEMBL5103386 0.65 HTR6 (0.54) HTR6HTR1ADRD2HTR2AHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008101247-A2 6 ' SUBSTITUTED INDOLE AND INDAZOLE DERIVATIVES HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2008-08-21 WO disclosed