SCHEMBL17081985

SCHEMBL17081985

CNC(=O)c1ccc(N2CCC[C@@]3(CCN(c4ccccc4Cl)C3=O)C2)nc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 3/20 0.42
DDB1 Q16531 1/20 0.42
HDAC1 Q13547 7/20 0.41
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39
CHRM4 P08173 1/20 0.38
HSD11B1 P28845 1/20 0.38
KCNH2 Q12809 4/20 0.38
HPGD P15428 1/20 0.37
PARP1 P09874 1/20 0.37
MAPK8 P45983 2/20 0.36
AOC3 Q16853 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
SCHEMBL549913 1.00 CRBN (0.42) CRBNDDB1HDAC1ALDH1A1SMN1; SMN2
SCHEMBL17081986 0.91 SMN1; SMN2 (0.43) CRBNDDB1HDAC1ALDH1A1SMN1; SMN2
SCHEMBL549509 0.91 SMN1; SMN2 (0.43) CRBNDDB1HDAC1ALDH1A1SMN1; SMN2
SCHEMBL2704081 0.83 HSD11B1 (0.41) CRBNALDH1A1CHRM4HSD11B1
SCHEMBL549536 0.83 HSD11B1 (0.41) CRBNALDH1A1CHRM4HSD11B1
SCHEMBL2701119 0.83 CRBN (0.44) CRBNSMN1; SMN2RAB9AHSD11B1
SCHEMBL3700460 0.83 CRBN (0.44) CRBNSMN1; SMN2RAB9AHSD11B1
SCHEMBL5930600 0.83 CRBN (0.44) CRBNSMN1; SMN2RAB9AHSD11B1
SCHEMBL17082048 0.82 CRBN (0.44) CRBNDDB1ALDH1A1SMN1; SMN2MAPK1
SCHEMBL4570054 0.82 CRBN (0.44) CRBNDDB1ALDH1A1SMN1; SMN2MAPK1

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