SCHEMBL17082010

SCHEMBL17082010

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.43
TP53 P04637 2/20 0.43
HPGD P15428 2/20 0.43
CRBN Q96SW2 2/20 0.41
MAPT P10636 4/20 0.40
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
KMT2A Q03164 1/20 0.38
RELA Q04206 1/20 0.38
CYP1A2 P05177 2/20 0.37
CYP2C19 P33261 1/20 0.37
DGAT1 O75907 7/20 0.37
TRPV1 Q8NER1 1/20 0.36
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
MTOR P42345 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL4570061 1.00 SMN1; SMN2 (0.43) SMN1; SMN2TP53HPGDCRBNMAPT
SCHEMBL17082012 0.94 CRBN (0.42) SMN1; SMN2HPGDCRBNMAPTCYP1A2
SCHEMBL4570060 0.94 CRBN (0.42) SMN1; SMN2HPGDCRBNMAPTCYP1A2
SCHEMBL4570144 0.92 CRBN (0.44) SMN1; SMN2TP53HPGDCRBNMAPT
SCHEMBL17082171 0.92 CRBN (0.44) SMN1; SMN2TP53HPGDCRBNMAPT
SCHEMBL4570059 0.90 CRBN (0.44) SMN1; SMN2CRBNMAPTNPC1RAB9A
SCHEMBL17082068 0.90 CRBN (0.44) SMN1; SMN2CRBNMAPTNPC1RAB9A
SCHEMBL17082006 0.90 CRBN (0.41) SMN1; SMN2CRBNMAPTNPC1RAB9A
SCHEMBL4570063 0.90 CRBN (0.41) SMN1; SMN2CRBNMAPTNPC1RAB9A
SCHEMBL17082079 0.88 SMN1; SMN2 (0.55) SMN1; SMN2TP53HPGDMAPTNPC1

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