SCHEMBL7009628

SCHEMBL7009628

CC1CNC(Cc2ccc(Cl)nc2)=N1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL7016009 0.86 ALDH1A1 (0.42) ALDH1A1LMNAL3MBTL1
SCHEMBL7011317 0.78 CHRNB2 (0.33) ALDH1A1
SCHEMBL1963688 0.74 TAAR1 (0.47) LMNAL3MBTL1
SCHEMBL7007927 0.71 HTR1D (0.57) LMNA
SCHEMBL7008008 0.71 CYP2A6 (0.41) ALDH1A1
SCHEMBL7007904 0.70 KDM1A (0.44) LMNAL3MBTL1GAAMAPT
SCHEMBL7009960 0.70 GAA (0.38) ALDH1A1LMNAL3MBTL1SMN1; SMN2GAA
SCHEMBL19787572 0.70
SCHEMBL7009355 0.69 HTR1D (0.47) LMNA
SCHEMBL7010617 0.69 LMNA (0.37) ALDH1A1LMNAL3MBTL1GAAMAPT

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-1280793-A2 CYCLIC AMIDINE COMPOUNDS AND THEIR USE AS ALPHA4BETA2 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS SUNTORY LIMITED (JP) 2003-02-05 EP disclosed
WO-2001081334-A2 CYCLIC AMIDINE COMPOUNDS AND THEIR USE AS ALPHA4BETA2 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS SUNTORY LIMITED (JP) 2001-11-01 WO disclosed