SCHEMBL14106926

SCHEMBL14106926

C=C/C(=C\C=C/N)S(=O)(=O)N(N)c1cc(N2CCCNCC2)ccc1C=C

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
HTR6 P50406 8/20 0.34
CHRNB2 P17787 7/20 0.34
CHRNA4 P43681 7/20 0.34
CHRNA1 P02708 1/20 0.31
CHRNA7 P36544 1/20 0.31
ATR Q13535 1/20 0.31
MAPT P10636 1/20 0.30
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30

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
SCHEMBL14106930 0.71 DYRK1A (0.37) ALDH1A1KDM4ELMNAHTR6CHRNB2
SCHEMBL14107045 0.69 HTR6 (0.50) HTR6
SCHEMBL14106935 0.69 KDM4E (0.40) ALDH1A1KDM4ELMNAHTR6
SCHEMBL14106929 0.69 GHSR (0.38) ALDH1A1KDM4ELMNAHTR6
SCHEMBL14106941 0.69 HTR6 (0.54) HTR6MAPT
SCHEMBL22673263 0.64 ADRB1 (0.58) HTR6CHRNB2CHRNA4CHRNA1CHRNA7
SCHEMBL27263501 0.62 PIK3CD (0.61) ALDH1A1KDM4ELMNAHTR6CHRNB2
SCHEMBL30826872 0.62 PIK3CD (0.61) ALDH1A1KDM4ELMNAHTR6CHRNB2
Hydrochloric Acid SCHEMBL3214277 0.60 CHRNB2 (0.62) ALDH1A1KDM4ELMNACHRNB2CHRNA4
SCHEMBL24028031 0.59 CHRNB2 (0.58) ALDH1A1KDM4ELMNACHRNB2CHRNA4

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