SCHEMBL7848968

SCHEMBL7848968

COc1ccc(N)cc1N1CCN2CCC1C2

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 3/20 0.47
LMNA P02545 1/20 0.47
NR4A1 P22736 1/20 0.39
USP2 O75604 1/20 0.35
GAA P10253 2/20 0.34
HTR3A P46098 2/20 0.34
CHRNA7 P36544 1/20 0.34
RAD52 P43351 1/20 0.33
GFER P55789 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
SHMT2 P34897 1/20 0.33
UGCG Q16739 1/20 0.33
DRD2 P14416 1/20 0.33
HTR2A P28223 1/20 0.33
HTR4 Q13639 1/20 0.33

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
SCHEMBL7848965 0.81 MAPK1 (0.41) MAPTALDH1A1KDM4ELMNAGAA
SCHEMBL30912449 0.71 ALDH1A1 (0.39) MAPTALDH1A1KDM4ELMNAUSP2
SCHEMBL30912556 0.71 ALDH1A1 (0.39) MAPTALDH1A1KDM4ELMNAUSP2
SCHEMBL3413033 0.70 ALDH1A1 (0.49) MAPTALDH1A1KDM4ELMNANR4A1
SCHEMBL6355490 0.70 ALDH1A1 (0.60) MAPTALDH1A1KDM4ELMNANR4A1
SCHEMBL10155726 0.69 KDM4E (0.46) MAPTALDH1A1KDM4ELMNARAD52
Hydrochloric Acid SCHEMBL6353868 0.69 ALDH1A1 (0.59) MAPTALDH1A1KDM4ELMNANR4A1
SCHEMBL4802022 0.69 ALDH1A1 (0.51) MAPTALDH1A1KDM4ELMNA
SCHEMBL21644440 0.69 ALDH1A1 (0.51) MAPTALDH1A1KDM4ELMNANR4A1
SCHEMBL4802029 0.69 ALDH1A1 (0.51) MAPTALDH1A1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1066288-A2 NOVEL COMPOUNDS SMITHKLINE BEECHAM PLC (GB) 2001-01-10 EP disclosed
WO-1999042465-A2 SULPHONAMIDE DERIVATIVES BEING 5-HT6 RECEPTOR ANTAGONISTS AND PROCESS FOR THEIR PREPARATION SMITHKLINE BEECHAM PLC (GB) 1999-08-26 WO disclosed