SCHEMBL7305660

SCHEMBL7305660

Cc1cc(C2=NNC(=O)CC2)ccc1OCCNCC(O)COc1ccc(CCOCC(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
KMT2A Q03164 1/20 0.44
ADRB3 P13945 1/20 0.40
LMNA P02545 1/20 0.40
NPY1R P25929 1/20 0.40
NPY2R P49146 1/20 0.40
ADRB2 P07550 2/20 0.39

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
SCHEMBL7304909 0.98 MAPT (0.43) MAPTKMT2AADRB3LMNANPY1R
SCHEMBL7304907 0.93 KMT2A (0.44) MAPTKMT2AADRB3LMNANPY1R
SCHEMBL7296572 0.91 ADRB1 (0.49) KMT2AADRB3LMNAADRB2
SCHEMBL7302226 0.88 LMNA (0.48) KMT2AADRB3LMNANPY1RNPY2R
SCHEMBL7299736 0.88 KMT2A (0.45) MAPTKMT2AADRB3LMNANPY1R
SCHEMBL7303245 0.87 ADRB2 (0.48) MAPTKMT2AADRB3LMNANPY1R
SCHEMBL7296328 0.87 LMNA (0.47) KMT2ALMNANPY1RNPY2RADRB2
SCHEMBL9686910 0.85 ADRB2 (0.47) MAPTKMT2AADRB3LMNANPY1R
SCHEMBL7297332 0.85 LMNA (0.47) MAPTKMT2AADRB3LMNANPY1R
SCHEMBL7296778 0.85 ATM (0.45) MAPTKMT2AADRB3LMNANPY1R

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