SCHEMBL11600993

SCHEMBL11600993

O=C(Oc1ccc2ccccc2c1)C(C(=O)Oc1ccc2ccccc2c1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.57
MAPT P10636 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
PTPN7 P35236 1/20 0.49
KDM4E B2RXH2 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
ALDH1A1 P00352 1/20 0.47
HSD17B10 Q99714 1/20 0.47
FABP7 O15540 1/20 0.47
FABP3 P05413 1/20 0.47
PPARG P37231 3/20 0.46
PPARA Q07869 3/20 0.46
MMP1 P03956 2/20 0.44
MMP12 P39900 1/20 0.44
SRC P12931 1/20 0.44
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43

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
SCHEMBL11600998 0.93 KMT2A (0.54) KMT2AMEN1MAPTTDP1PTPN7
SCHEMBL10710434 0.83 TDP1 (0.54) KMT2AMEN1MAPTTDP1PTPN7
SCHEMBL11603067 0.81 L3MBTL1 (0.59) KMT2AMAPTTDP1KDM4EL3MBTL1
SCHEMBL28172274 0.80 KMT2A (0.58) KMT2AMEN1MAPTTDP1PTPN7
SCHEMBL31323056 0.80 KMT2A (0.50) KMT2AMEN1MAPTTDP1PTPN7
SCHEMBL31322986 0.79 ELANE (0.57) KMT2AMEN1MAPTTDP1PTPN7
SCHEMBL11996303 0.79 ELANE (0.57) KMT2AMEN1MAPTTDP1PTPN7
SCHEMBL7869800 0.78 KMT2A (0.56) KMT2AMEN1MAPTTDP1PTPN7
SCHEMBL7869801 0.78 KMT2A (0.56) KMT2AMEN1MAPTTDP1PTPN7
SCHEMBL1563903 0.77 KMT2A (0.69) KMT2AMEN1MAPTTDP1PTPN7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4072710-A FROM SILYL ESTER AND THIONYL CHLORIDE PALOMO COLL A L 1978-02-07 US disclosed