SCHEMBL7609731

SCHEMBL7609731

COC(=O)Oc1cc(Br)cc(OC(=O)OC)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.42
KDM4E B2RXH2 3/20 0.42
HPGD P15428 1/20 0.42
ALDH1A1 P00352 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
CYP1A2 P05177 3/20 0.39
MAPT P10636 3/20 0.38
GAA P10253 2/20 0.38
RECQL P46063 1/20 0.38
PIM1 P11309 1/20 0.36
CUL4A Q13619 1/20 0.36
NOTUM Q6P988 1/20 0.35
LMNA P02545 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
RAB9A P51151 2/20 0.33
CASP3 P42574 2/20 0.33
AR P10275 1/20 0.33
NPC1 O15118 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33

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
SCHEMBL2920954 0.78 KDM4E (0.44) HSD17B10KDM4EHPGDALDH1A1L3MBTL1
SCHEMBL5198345 0.77 L3MBTL1 (0.54) HSD17B10KDM4EHPGDALDH1A1L3MBTL1
SCHEMBL19356924 0.75 MAPT (0.46) HSD17B10KDM4EALDH1A1L3MBTL1CYP1A2
SCHEMBL6225917 0.75 KDM4E (0.48) HSD17B10KDM4EHPGDALDH1A1L3MBTL1
SCHEMBL27601386 0.73 HSD17B10 (0.52) HSD17B10KDM4EHPGDALDH1A1MAPT
SCHEMBL9196259 0.73 CYP1A2 (0.53) KDM4EALDH1A1CYP1A2MAPTGAA
SCHEMBL9196304 0.73 KMT2A (0.54) KDM4EHPGDALDH1A1CYP1A2MAPT
SCHEMBL9194034 0.73 LMNA (0.56) KDM4EALDH1A1L3MBTL1CYP1A2LMNA
SCHEMBL18196544 0.72 HSD17B10 (0.54) HSD17B10KDM4EHPGDALDH1A1PIM1
SCHEMBL3985855 0.72 KDM4E (0.46) HSD17B10KDM4EHPGDALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0778844-B1 FUNCTIONAL TERPYRIDINE METAL COMPLEXES, METHODS FOR THEIR PREPARATION AND OLIGONUCLEOTIDE CONJUGATES WITH TERPYRIDINE METAL COMPLEXES NOVARTIS AG (CH) 2002-12-18 EP disclosed
EP-0778845-A1 OLIGONUCLEOTIDE CONJUGATES, COMPOSITIONS AND METHODS FOR SPLITTING RIBONUCLEIC ACIDS Novartis AG (CH) 1997-06-18 EP disclosed
EP-0778844-A1 FUNCTIONAL TERPYRIDINE METAL COMPLEXES, METHODS FOR THEIR PREPARATION AND OLIGONUCLEOTIDE CONJUGATES WITH TERPYRIDINE METAL COMPLEXES Novartis AG (CH) 1997-06-18 EP disclosed
WO-1996007668-A1 FUNCTIONAL TERPYRIDINE METAL COMPLEXES, METHODS FOR THEIR PREPARATION AND OLIGONUCLEOTIDE CONJUGATES WITH TERPYRIDINE METAL COMPLEXES NOVARTIS AG (CH) 1996-03-14 WO disclosed
WO-1996007667-A1 OLIGONUCLEOTIDE CONJUGATES, COMPOSITIONS AND METHODS FOR SPLITTING RIBONUCLEIC ACIDS NOVARTIS AG (CH) 1996-03-14 WO disclosed