SCHEMBL7954271

SCHEMBL7954271

CCOC(=O)c1c(C)c2c(n1Cc1ccc(Cl)c(Cl)c1)CCCCC2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
MAPT P10636 3/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 6/20 0.47
GAA P10253 2/20 0.47
HTT P42858 1/20 0.47
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 1/20 0.46
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.42
POLB P06746 2/20 0.41
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
CCR2 P41597 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
P2RY12 Q9H244 1/20 0.39
PDE3B Q13370 1/20 0.39
PDE3A Q14432 1/20 0.39
FABP4 P15090 1/20 0.39
OPRK1 P41145 1/20 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
SCHEMBL7046362 0.84 HDAC1 (0.51) LMNAMAPTRAB9ASMN1; SMN2GAA
SCHEMBL7049001 0.79 SMN1; SMN2 (0.45) LMNAMAPTRAB9ASMN1; SMN2GAA
SCHEMBL7047270 0.78 MAPT (0.48) LMNAMAPTRAB9ASMN1; SMN2GAA
SCHEMBL7050361 0.77 TSHR (0.43) LMNAMAPTRAB9ASMN1; SMN2GAA
SCHEMBL7969831 0.77 MAPT (0.47) LMNAMAPTRAB9ASMN1; SMN2GAA
SCHEMBL7158730 0.75 RAB9A (0.46) LMNAMAPTRAB9ASMN1; SMN2GAA
SCHEMBL23422191 0.73 LMNA (0.58) LMNAMAPTRAB9AGAAHTT
SCHEMBL7048477 0.73 TP53 (0.40) LMNAMAPTRAB9ASMN1; SMN2GAA
SCHEMBL6595452 0.71 ABCB11 (0.56) LMNAMAPTSMN1; SMN2GAAHTT
SCHEMBL5213680 0.70 CCR2 (0.65) LMNAMAPTSMN1; SMN2GAAHTT

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
US-6291507-B1 INHIBITOR OF MONOCYTE CHEMOATTRACTANT PROTEIN-1; INDOLE DERIVATIVES ASTRAZENECA UK LIMITED (GB) 2001-09-18 US disclosed