SCHEMBL6537686

SCHEMBL6537686

CCOC(=O)c1cnc2c(NC(=O)c3c(Cl)cccc3Cl)cccc2c1CBr

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
TP53 P04637 3/20 0.43
NPSR1 Q6W5P4 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
HTT P42858 1/20 0.43
POLB P06746 2/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
THRB P10828 1/20 0.40

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
SCHEMBL6538068 0.90 MAPT (0.45) MAPTMEN1KMT2ASMN1; SMN2TP53
SCHEMBL6538315 0.90 MAPT (0.45) MAPTMEN1KMT2ASMN1; SMN2TP53
SCHEMBL6538090 0.89 TP53 (0.44) MAPTMEN1KMT2ASMN1; SMN2TP53
SCHEMBL6537838 0.89 MAPT (0.46) MAPTMEN1KMT2ASMN1; SMN2TP53
SCHEMBL6538112 0.89 MAPT (0.43) MAPTMEN1KMT2ASMN1; SMN2TP53
SCHEMBL6538111 0.88 KMT2A (0.58) MAPTMEN1KMT2ASMN1; SMN2TP53
SCHEMBL6537629 0.88 MAPT (0.50) MAPTMEN1KMT2ASMN1; SMN2TP53
SCHEMBL6537846 0.88 MAPT (0.43) MAPTMEN1KMT2ASMN1; SMN2TP53
SCHEMBL6537564 0.87 MEN1 (0.48) MAPTMEN1KMT2ASMN1; SMN2TP53
SCHEMBL6538187 0.86 MAPT (0.46) MAPTMEN1KMT2ASMN1; SMN2TP53

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