SCHEMBL5317403

SCHEMBL5317403

CCN1CCCC(NC)CC1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
EPHX1 P07099 1/20 0.37
EPHX2 P34913 1/20 0.37
KMT2A Q03164 2/20 0.37
CYP2D6 P10635 1/20 0.37
EHMT2 Q96KQ7 1/20 0.36
RECQL P46063 1/20 0.36
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
HSD11B1 P28845 1/20 0.34
HRH3 Q9Y5N1 1/20 0.33
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL579037 0.91 SMN1; SMN2 (0.43) KDM4ESMN1; SMN2EPHX1EPHX2KMT2A
Hydrochloric Acid SCHEMBL27714482 0.89 SMN1; SMN2 (0.42) KDM4ESMN1; SMN2EPHX1EPHX2KMT2A
SCHEMBL10271865 0.83 GAA (0.41) KDM4EGAA
SCHEMBL1488354 0.83 GAA (0.41) KDM4EGAA
SCHEMBL23133624 0.83 GAA (0.41) KDM4EGAA
Hydrochloric Acid SCHEMBL28253888 0.82 GAA (0.40) KDM4EGAA
SCHEMBL26706476 0.80 ACHE (0.41) KDM4ESMN1; SMN2EPHX1EPHX2KMT2A
SCHEMBL2549878 0.78
SCHEMBL15079109 0.78
SCHEMBL13832821 0.78

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