SCHEMBL17082012

SCHEMBL17082012

CCOC(=O)Nc1ccc(N2CCC[C@@]3(CCN(C4CCOCC4)C3=O)C2)nc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.42
DGAT1 O75907 10/20 0.40
CYP1A2 P05177 3/20 0.40
MAPT P10636 2/20 0.40
CYP2C19 P33261 1/20 0.40
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PDE7A Q13946 1/20 0.36
WNT3A P56704 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
SCHEMBL4570060 1.00 CRBN (0.42) CRBNDGAT1CYP1A2MAPTCYP2C19
SCHEMBL4570061 0.94 SMN1; SMN2 (0.43) CRBNDGAT1CYP1A2MAPTCYP2C19
SCHEMBL17082010 0.94 SMN1; SMN2 (0.43) CRBNDGAT1CYP1A2MAPTCYP2C19
SCHEMBL4570143 0.92 CRBN (0.45) CRBNDGAT1MAPTALDH1A1LMNA
SCHEMBL17082009 0.92 CRBN (0.45) CRBNDGAT1MAPTALDH1A1LMNA
SCHEMBL4570059 0.92 CRBN (0.44) CRBNDGAT1CYP1A2MAPTCYP2C19
SCHEMBL17082068 0.92 CRBN (0.44) CRBNDGAT1CYP1A2MAPTCYP2C19
SCHEMBL17082006 0.91 CRBN (0.41) CRBNDGAT1CYP1A2MAPTCYP2C19
SCHEMBL4570063 0.91 CRBN (0.41) CRBNDGAT1CYP1A2MAPTCYP2C19
SCHEMBL2697801 0.89 CRBN (0.44) CRBNDGAT1CYP1A2MAPTCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1812005-B1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2015-09-16 EP disclosed