SCHEMBL8634771

SCHEMBL8634771

COC(=O)c1sccc1CCI

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.51
MEN1 O00255 3/20 0.49
CYP1A2 P05177 1/20 0.49
NPC1 O15118 1/20 0.46
HPGD P15428 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MAPK10 P53779 4/20 0.43
MAPK8 P45983 3/20 0.43
MAPK9 P45984 3/20 0.43
ALDH1A1 P00352 3/20 0.43
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
KDM4E B2RXH2 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
LMNA P02545 2/20 0.42
MAPT P10636 1/20 0.42
CASP3 P42574 2/20 0.42
SENP7 Q9BQF6 2/20 0.42

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
SCHEMBL6625082 0.85 KMT2A (0.57) KMT2AMEN1CYP1A2NPC1HPGD
SCHEMBL8636706 0.85 KMT2A (0.53) KMT2AMEN1CYP1A2NPC1HPGD
SCHEMBL8630249 0.82 KMT2A (0.62) KMT2AMEN1CYP1A2NPC1HPGD
SCHEMBL28763196 0.82 KMT2A (0.54) KMT2AMEN1CYP1A2NPC1HPGD
SCHEMBL4683311 0.81 KMT2A (0.56) KMT2AMEN1CYP1A2NPC1HPGD
SCHEMBL23142270 0.81 KMT2A (0.49) KMT2AMEN1CYP1A2NPC1HPGD
SCHEMBL13098077 0.81 KMT2A (0.53) KMT2AMEN1CYP1A2NPC1HPGD
SCHEMBL6621712 0.81 KMT2A (0.49) KMT2AMEN1CYP1A2NPC1HPGD
SCHEMBL28898181 0.80 KMT2A (0.48) KMT2AMEN1CYP1A2NPC1HPGD
SCHEMBL28860026 0.80 MAPK8 (0.57) KMT2AMEN1CYP1A2NPC1HPGD

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
WO-1998042347-A1 PHARMACEUTICAL COMPOSITION CONTAINING A PHOSPHORYLAMIDE AND AN AYNTIBIOTIC TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-10-01 WO disclosed
EP-0852498-A1 PHOSPHORYLAMIDES, THEIR PREPARATION AND USE Takeda Chemical Industries, Ltd. (JP) 1998-07-15 EP disclosed
WO-1997011705-A1 PHOSPHORYLAMIDES, THEIR PREPARATION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-04-03 WO disclosed