SCHEMBL5318323

SCHEMBL5318323

CCCN1CC[CH]CC1C(=O)NCCOC

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
TACR1 P25103 1/20 0.40
ATM Q13315 3/20 0.37
HPGD P15428 3/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KDM4E B2RXH2 5/20 0.37
TDP1 Q9NUW8 2/20 0.36
CYP3A4 P08684 1/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 3/20 0.35
LMNA P02545 2/20 0.34
KCNK3 O14649 1/20 0.34
CYP2C19 P33261 1/20 0.34
EPHX2 P34913 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
SCHEMBL13102177 0.80 MAPT (0.48) MAPTATMHPGDKDM4ETDP1
SCHEMBL1200363 0.79 FKBP1A (0.39) MAPTCYP3A4LMNAKCNK3
SCHEMBL3963948 0.73 SMN1; SMN2 (0.36) LMNAKCNK3
SCHEMBL2685827 0.72 OPRM1 (0.35) HPGDKDM4EALDH1A1
SCHEMBL5317670 0.70 ALDH1A1 (0.36) KDM4ECYP3A4KMT2AALDH1A1
SCHEMBL3834072 0.69 KDM4E (0.48) MAPTATMHPGDL3MBTL1KDM4E
Hydrochloric Acid SCHEMBL3830058 0.68 TDP1 (0.48) MAPTATMHPGDL3MBTL1KDM4E
SCHEMBL13102199 0.67 MAPT (0.57) MAPTATMHPGDL3MBTL1KDM4E
SCHEMBL13995369 0.67 KDM4E (0.44) MAPTATMHPGDL3MBTL1KDM4E
SCHEMBL23920414 0.65 NR1I2 (0.45) L3MBTL1CYP3A4LMNAEPHX2

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
WO-2007069053-A1 BENZIMIDAZOLE ANTAGONISTS OF THE H-3 RECEPTOR PFIZER PRODUCTS INC. (US) 2007-06-21 WO claimed
WO-2007069053-A1 BENZIMIDAZOLE ANTAGONISTS OF THE H-3 RECEPTOR PFIZER PRODUCTS INC. (US) 2007-06-21 WO disclosed