SCHEMBL6537550

SCHEMBL6537550

CCOC(=O)c1cnc2c(NC(=O)c3c(Cl)cccc3Cl)cccc2c1CN(C)CCOC

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
KMT2A Q03164 5/20 0.40
MEN1 O00255 4/20 0.40
MAPT P10636 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 4/20 0.39
RAD52 P43351 2/20 0.39
TP53 P04637 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
UHRF1 Q96T88 1/20 0.38
F10 P00742 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
SCHEMBL6537838 0.89 MAPT (0.46) KMT2AMEN1MAPTSMN1; SMN2POLB
SCHEMBL6537969 0.89 KMT2A (0.39) KMT2AMEN1MAPTSMN1; SMN2POLB
SCHEMBL6537846 0.85 MAPT (0.43) KMT2AMEN1MAPTSMN1; SMN2POLB
SCHEMBL6538315 0.84 MAPT (0.45) KMT2AMEN1MAPTSMN1; SMN2POLB
SCHEMBL6537686 0.84 MAPT (0.45) KMT2AMEN1MAPTSMN1; SMN2POLB
SCHEMBL6538068 0.84 MAPT (0.45) KMT2AMEN1MAPTSMN1; SMN2POLB
SCHEMBL6538090 0.83 TP53 (0.44) KMT2AMEN1MAPTSMN1; SMN2POLB
SCHEMBL6537564 0.83 MEN1 (0.48) KMT2AMEN1MAPTSMN1; SMN2POLB
SCHEMBL6538112 0.82 MAPT (0.43) KMT2AMEN1MAPTSMN1; SMN2POLB
SCHEMBL6538105 0.82 MAPT (0.45) KMT2AMEN1MAPTSMN1; SMN2POLB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0876345-B1 HETEROCYCLIC COMPOUNDS AS H+-ATPASES FUJISAWA PHARMACEUTICAL CO (JP) 2004-08-18 EP disclosed
US-6008230-A TREATING BONE DISEASES CAUSED BY ABNORMAL BONE METABOLISM IN HUMAN BEING OR ANIMALS AS THE INHIBITORS OF BONE RESORPTION OR THE INHIBITORS OF BONE METASTASIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-12-28 US disclosed
EP-0876345-A1 HETEROCYCLIC COMPOUNDS AS H+-ATPASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-11-11 EP disclosed
WO-1997014681-A1 HETEROCYCLIC COMPOUNDS AS H+-ATPASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-04-24 WO disclosed