SCHEMBL7294654

SCHEMBL7294654

NCCOc1cccc(C2=NNC(=O)CC2)c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.54
LMNA P02545 1/20 0.54
NPY1R P25929 1/20 0.54
NPY2R P49146 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.52
KMT2A Q03164 1/20 0.51
HRH3 Q9Y5N1 3/20 0.48
PDE3B Q13370 8/20 0.47
PDE3A Q14432 8/20 0.47
PDE4B Q07343 4/20 0.47
PDE4A P27815 3/20 0.47
PDE4C Q08493 3/20 0.47
PDE4D Q08499 3/20 0.47
GPR119 Q8TDV5 2/20 0.43
GSK3B P49841 1/20 0.40

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
SCHEMBL7308328 0.94 LMNA (0.56) MAPTLMNANPY1RNPY2RSMN1; SMN2
SCHEMBL10965995 0.87 MAPT (0.72) MAPTLMNANPY1RNPY2RSMN1; SMN2
SCHEMBL10967557 0.84 MAPT (0.56) MAPTLMNANPY1RNPY2RSMN1; SMN2
SCHEMBL6795295 0.84 MAPT (0.75) MAPTLMNANPY1RNPY2RSMN1; SMN2
SCHEMBL10967061 0.81 SMN1; SMN2 (0.51) MAPTLMNANPY1RNPY2RSMN1; SMN2
SCHEMBL5309374 0.80 PDE3B (0.63) MAPTLMNANPY1RNPY2RSMN1; SMN2
SCHEMBL11632296 0.79 SMN1; SMN2 (0.54) MAPTLMNANPY1RNPY2RSMN1; SMN2
SCHEMBL4900340 0.79 PDE3B (0.55) MAPTLMNANPY1RNPY2RSMN1; SMN2
SCHEMBL7296314 0.78 PDE3B (0.57) MAPTLMNANPY1RNPY2RSMN1; SMN2
SCHEMBL7306239 0.77 LMNA (0.78) MAPTLMNANPY1RNPY2RSMN1; SMN2

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
US-5135932-A 2-HYDROXYPROPYLAMINO-ALKYL-BENZIMIDAZOLY-5-YL DERIVATIVES AND THEIR USE IN THE TREATMENT OF HEART DISEASE DR. KARL THOMAE GMBH (DE) 1992-08-04 US disclosed
EP-0400519-A1 2-Hydroxy-n-propylamines, medicaments containing these compounds and method for preparing them Dr. Karl Thomae GmbH (DE) 1990-12-05 EP disclosed