SCHEMBL7982673

SCHEMBL7982673

NC(=O)CC(=O)Oc1ccc(Br)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
MAPT P10636 4/20 0.46
LMNA P02545 2/20 0.46
ALDH1A1 P00352 1/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MGLL Q99685 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
OGG1 O15527 1/20 0.42
LDHA P00338 1/20 0.40
GAA P10253 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
RXFP1 Q9HBX9 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
SCHEMBL1820226 0.88 KMT2A (0.52) KMT2AMEN1MAPTLMNAALDH1A1
SCHEMBL20476548 0.82 KMT2A (0.47) KMT2AMEN1MAPTLMNAALDH1A1
SCHEMBL26924223 0.81 KMT2A (0.50) KMT2AMEN1MAPTLMNAALDH1A1
SCHEMBL171835 0.80 PRSS1 (0.50) KMT2AMEN1MAPTLMNAALDH1A1
SCHEMBL5328134 0.80 KMT2A (0.44) KMT2AMEN1MAPTLMNAALDH1A1
SCHEMBL4643302 0.78 KMT2A (0.45) KMT2AMEN1MAPTLMNAALDH1A1
SCHEMBL27502925 0.78 MGLL (0.42) KMT2AMEN1MAPTLMNAALDH1A1
SCHEMBL936193 0.77 MEN1 (0.52) KMT2AMEN1MAPTLMNAMGLL
SCHEMBL1821398 0.76 KMT2A (0.63) KMT2AMEN1MAPTLMNAALDH1A1
SCHEMBL4643998 0.76 MGLL (0.46) KMT2AMEN1MAPTLMNAALDH1A1

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
US-6300352-B1 FOR THERAPY OF ASTHMA ASTRAZENECA AB (SE) 2001-10-09 US disclosed
CN-1257481-A Pyridine derivatives and pharmaceutical compositions containing them ASTRA PHARMA PROD (GB) 2000-06-21 CN disclosed
EP-0971892-A1 NOVEL PYRIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Astra Pharmaceuticals Limited (GB) 2000-01-19 EP disclosed
WO-1998042670-A1 NOVEL PYRIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ASTRA PHARMACEUTICALS LTD. (GB) 1998-10-01 WO disclosed