SCHEMBL9470261

SCHEMBL9470261

CCCCCCCCCC(=O)Cl.CCCCCCCCCc1nnc(NC(=O)Nc2c(C(C)C)cccc2C(C)C)s1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GLS O94925 1/20 0.49
POLB P06746 2/20 0.48
RAB9A P51151 1/20 0.48
DNMT1 P26358 1/20 0.48
NPSR1 Q6W5P4 1/20 0.47
SOAT1 P35610 1/20 0.47
MEN1 O00255 1/20 0.46
GAPDH P04406 1/20 0.46
ALOX15 P16050 1/20 0.46
NR4A1 P22736 1/20 0.46
APEX1 P27695 1/20 0.46
PTPN7 P35236 1/20 0.46
BLM P54132 1/20 0.46
KMT2A Q03164 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL9471443 1.00 GLS (0.49) GLSPOLBRAB9ADNMT1NPSR1
SCHEMBL9470785 0.93 POLB (0.54) GLSPOLBRAB9ADNMT1NPSR1
SCHEMBL9729026 0.75
SCHEMBL9728949 0.74
SCHEMBL9729953 0.74
SCHEMBL3455447 0.70 TSHR (0.75) GLSPOLBRAB9ADNMT1NPSR1
SCHEMBL9469938 0.70
SCHEMBL9559085 0.70 P2RY1 (0.58)
SCHEMBL10699124 0.70 SOAT1 (0.69) SOAT1SMN1; SMN2
SCHEMBL8823162 0.70

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-5185358-A Anticholesterol agents WARNER-LAMBERT CO. (US) 1993-02-09 US disclosed