SCHEMBL1382882

SCHEMBL1382882

CN(C)c1ncc(C(=O)NCCC(O)c2cccc(NC(=O)C3CCCC3)c2)c(-c2ccccc2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
RXFP1 Q9HBX9 1/20 0.41
POLB P06746 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
USP2 O75604 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KCNK3 O14649 1/20 0.39
KCNK9 Q9NPC2 1/20 0.39
CASR P41180 4/20 0.38
JAK2 O60674 1/20 0.38
AURKA O14965 1/20 0.38
RPS6KB1 P23443 1/20 0.38
ABL1 P00519 1/20 0.37
PDGFRB P09619 1/20 0.37
BCR P11274 1/20 0.37
SRC P12931 1/20 0.37
PDGFRA P16234 1/20 0.37

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
SCHEMBL1386672 0.87 KMT2A (0.43) LMNAPOLBSMN1; SMN2L3MBTL1KCNK3
SCHEMBL1385564 0.86 CASR (0.40) LMNARXFP1POLBSMN1; SMN2L3MBTL1
SCHEMBL1383781 0.86 EPHX2 (0.45) LMNAPOLBSMN1; SMN2KCNK3KCNK9
SCHEMBL1386210 0.84 EPHX2 (0.42) LMNAPOLBSMN1; SMN2L3MBTL1KCNK3
SCHEMBL1386145 0.84 CASR (0.39) LMNARXFP1POLBCASR
SCHEMBL1384916 0.83 EPHX2 (0.45) LMNAPOLBSMN1; SMN2TSHRKCNK3
SCHEMBL1385431 0.83 MAPT (0.42) LMNASMN1; SMN2HPGDKCNK3KCNK9
SCHEMBL1384630 0.83 SMN1; SMN2 (0.42) LMNAPOLBSMN1; SMN2L3MBTL1KCNK3
SCHEMBL1386047 0.83 CASR (0.44) LMNAPOLBKCNK3KCNK9CASR
SCHEMBL1383762 0.82 KCNK3 (0.42) LMNARXFP1POLBSMN1; SMN2HPGD

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
JP-4825686-B2 2011-11-30 JP claimed