SCHEMBL9358199

SCHEMBL9358199

CC(C)(O)CNc1ccc(NCC(C)(C)O)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.54
KMT2A Q03164 6/20 0.54
POLB P06746 4/20 0.54
BLM P54132 3/20 0.54
NSD2 O96028 1/20 0.54
RXFP1 Q9HBX9 1/20 0.54
RAB9A P51151 3/20 0.54
NPC1 O15118 2/20 0.54
MTOR P42345 1/20 0.54
SIRT2 Q8IXJ6 1/20 0.54
TOP2B Q02880 1/20 0.53
TERT O14746 7/20 0.44
MAPT P10636 7/20 0.42
MAPK1 P28482 4/20 0.42
L3MBTL1 Q9Y468 4/20 0.42
TDP1 Q9NUW8 4/20 0.42
LMNA P02545 4/20 0.42
NPSR1 Q6W5P4 2/20 0.42
EGFR P00533 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41

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
SCHEMBL7962661 0.84 TOP2B (0.54) MEN1KMT2APOLBBLMNSD2
SCHEMBL9517779 0.77 MEN1 (0.48) MEN1KMT2APOLBBLMNSD2
SCHEMBL30678386 0.77 MEN1 (0.60) MEN1KMT2APOLBBLMNSD2
SCHEMBL29366166 0.77 MEN1 (0.60) MEN1KMT2APOLBBLMNSD2
SCHEMBL78525 0.77 MEN1 (0.60) MEN1KMT2APOLBBLMNSD2
SCHEMBL5695954 0.75 MEN1 (0.55) MEN1KMT2APOLBBLMNSD2
SCHEMBL4655713 0.74 MAPT (0.54) MEN1KMT2APOLBBLMNSD2
SCHEMBL2421375 0.74 MEN1 (0.54) MEN1KMT2APOLBBLMNSD2
SCHEMBL11131632 0.74 POLB (0.63) MEN1KMT2APOLBBLMNSD2
SCHEMBL1426702 0.74 TOP2B (0.81) MEN1KMT2APOLBBLMNSD2

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-0333337-B1 Thermal transfer sheet ZENECA LTD (GB) 1994-12-21 EP disclosed
US-5102448-A Hot melt of solid ink composition IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-04-07 US disclosed
US-4933426-A POLYLACTONE CONTAINING BOUND DYE, WAX REPLACEMENT IN THERMAL WAX TRANSFER IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-06-12 US disclosed
EP-0371627-A2 Ink-jet printing ZENECA LIMITED (GB) 1990-06-06 EP disclosed
EP-0333337-A2 Thermal transfer sheet ZENECA LIMITED (GB) 1989-09-20 EP disclosed