SCHEMBL5500670

SCHEMBL5500670

CCN(CC)c1cccc2c1C(c1ccccc1)c1ccccc1O2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.41
KMT2A Q03164 6/20 0.41
USP2 O75604 2/20 0.41
LMNA P02545 3/20 0.38
MAPT P10636 3/20 0.38
NPSR1 Q6W5P4 3/20 0.38
HTT P42858 3/20 0.38
NISCH Q9Y2I1 1/20 0.38
CYP2C9 P11712 2/20 0.37
TSHR P16473 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPK1 P28482 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
GAA P10253 2/20 0.34
ALDH1A1 P00352 1/20 0.34
ALOX15 P16050 1/20 0.34
ATM Q13315 1/20 0.33
NPC1 O15118 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
SCHEMBL5501387 0.85 MEN1 (0.40) MEN1KMT2AUSP2LMNAMAPT
SCHEMBL5501554 0.84 MEN1 (0.40) MEN1KMT2AUSP2LMNAMAPT
SCHEMBL10933585 0.82 MEN1 (0.40) MEN1KMT2AUSP2LMNAMAPT
SCHEMBL5495275 0.81 KMT2A (0.44) MEN1KMT2AUSP2LMNAMAPT
SCHEMBL2885668 0.78 HTT (0.45) MEN1KMT2AUSP2LMNAMAPT
SCHEMBL1985472 0.77 CYP2C9 (0.44) MEN1KMT2AUSP2LMNAMAPT
SCHEMBL11781441 0.74 CYP2C9 (0.44) MEN1KMT2ALMNAMAPTNPSR1
SCHEMBL5501909 0.74 GRM8 (0.43) MEN1KMT2AUSP2MAPTNPSR1
SCHEMBL9407337 0.73 AHR (0.46) MEN1KMT2ALMNAMAPTNPSR1
SCHEMBL11855411 0.73 CYP2C9 (0.42) MEN1KMT2ALMNAMAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1765592-A1 METHOD FOR MAKING NEGATIVE-WORKING HEAT-SENSITIVE LITHOGRAPHIC PRINTING PLATE PRECURSOR Agfa Graphics N.V. (BE) 2007-03-28 EP disclosed
WO-2006005688-A1 METHOD FOR MAKING NEGATIVE-WORKING HEAT-SENSITIVE LITHOGRAPHIC PRINTING PLATE PRECURSOR. AGFA-GEVAERT (BE) 2006-01-19 WO disclosed