SCHEMBL7604247

SCHEMBL7604247

CC(CCN1CCOCC1=O)N1COCC1=O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
PER2 O15055 2/20 0.33
CRY2 Q49AN0 1/20 0.33
ACHE P22303 1/20 0.32
USP19 O94966 1/20 0.32
MCHR1 Q99705 1/20 0.31
PDK2 Q15119 1/20 0.30

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
SCHEMBL7605032 0.88 ACHE (0.32) PRMT5WDR77PER2CRY2ACHE
SCHEMBL7608770 0.88
SCHEMBL7607202 0.84 PIK3CD (0.45)
SCHEMBL7603912 0.83 PIK3CD (0.41) PER2ACHE
SCHEMBL7603122 0.83 PIK3CD (0.37) PRMT5WDR77PER2CRY2ACHE
SCHEMBL7606074 0.82 PIK3CD (0.40) PER2ACHE
SCHEMBL7605230 0.82 CHRM2 (0.35) PRMT5WDR77PER2CRY2ACHE
SCHEMBL6888871 0.81 SMN1; SMN2 (0.41) PRMT5WDR77PER2CRY2ACHE
SCHEMBL7603856 0.81 CHRM2 (0.35) PRMT5WDR77PER2CRY2USP19
SCHEMBL7603320 0.80 PIK3CD (0.44)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934080-B1 1,3-BIS-(N-LACTAMYL) PROPANE AND THE PHARMACEUTICAL AND COSMETIC USE THEREOF BASF AG (DE) 2002-06-12 EP claimed
US-6497886-B1 SOLVENTS FOR PHARMACEUTICAL PREPARATIONS WHICH, BESIDES EXCELLENT DISSOLVING CAPACITY FOR ACTIVE INGREDIENT USED, ALSO PROVIDE EXCELLENT MISCIBILITY WITH OTHER SOLVENTS AND GOOD PHYSIOLOGICAL TOLERABILITY BASF AKTIENGESELLSCHAFT (DE) 2002-12-24 US disclosed
EP-0934080-B1 1,3-BIS-(N-LACTAMYL) PROPANE AND THE PHARMACEUTICAL AND COSMETIC USE THEREOF BASF AG (DE) 2002-06-12 EP disclosed