SCHEMBL7437824

SCHEMBL7437824

Cc1nc2nc(NC(O)CCC(C)C)n(C)c(=O)c2n1Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.43
ALDH1A1 P00352 4/20 0.43
TSHR P16473 2/20 0.43
ALOX15 P16050 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
MAPT P10636 7/20 0.41
PCSK9 Q8NBP7 1/20 0.41
USP2 O75604 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HPGD P15428 2/20 0.40
KDM4E B2RXH2 2/20 0.40
RAB9A P51151 1/20 0.40
HTT P42858 3/20 0.40
MAPK1 P28482 2/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
GAA P10253 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
SCHEMBL7445277 0.91 LMNA (0.43) LMNAALDH1A1TSHRALOX15SMN1; SMN2
SCHEMBL7438089 0.89 MAPT (0.44) LMNAALDH1A1TSHRALOX15SMN1; SMN2
SCHEMBL7438872 0.89 LMNA (0.45) LMNAALDH1A1TSHRALOX15SMN1; SMN2
SCHEMBL7442836 0.88 MAPT (0.45) LMNAALDH1A1TSHRALOX15SMN1; SMN2
SCHEMBL8798829 0.86 LMNA (0.41) LMNAALDH1A1TSHRALOX15SMN1; SMN2
SCHEMBL7438860 0.85 PCSK9 (0.49) LMNAALDH1A1TSHRALOX15SMN1; SMN2
SCHEMBL7437818 0.84 PCSK9 (0.44) LMNAALDH1A1TSHRALOX15SMN1; SMN2
SCHEMBL7445273 0.84 PCSK9 (0.43) LMNAALDH1A1TSHRALOX15SMN1; SMN2
SCHEMBL7438080 0.82 PCSK9 (0.42) LMNAALDH1A1TSHRALOX15SMN1; SMN2
SCHEMBL7439319 0.82 LMNA (0.47) LMNAALDH1A1TSHRALOX15SMN1; SMN2

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-0538332-B1 POLYCYCLIC GUANINE DERIVATIVES SCHERING CORP (US) 1997-07-23 EP disclosed
US-5393755-A Hypotensive agents, enzyme inhibitors SCHERING CORPORATION (US) 1995-02-28 US disclosed
WO-1991019717-A1 POLYCYCLIC GUANINE DERIVATIVES SCHERING CORPORATION (US) 1991-12-26 WO disclosed