SCHEMBL5501554

SCHEMBL5501554

CCN(CC)c1cccc2c1C(c1ccccc1Cl)c1ccccc1O2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
USP2 O75604 1/20 0.40
AHR P35869 2/20 0.37
KDM1A O60341 1/20 0.36
RCOR1 Q9UKL0 1/20 0.36
NISCH Q9Y2I1 1/20 0.36
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CRHR1 P34998 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
HTR2B P41595 1/20 0.33
CYP2C9 P11712 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) MEN1KMT2AUSP2NISCHTSHR
SCHEMBL5501565 0.85 AHR (0.40) MEN1KMT2AUSP2AHRKDM1A
SCHEMBL5500670 0.84 MEN1 (0.41) MEN1KMT2AUSP2NISCHTSHR
SCHEMBL27851777 0.81 MEN1 (0.39) MEN1KMT2AUSP2NISCHTSHR
SCHEMBL5495275 0.79 KMT2A (0.44) MEN1KMT2AUSP2TSHRSMN1; SMN2
SCHEMBL1985472 0.77 CYP2C9 (0.44) MEN1KMT2AUSP2TSHRSMN1; SMN2
SCHEMBL3907415 0.76 MEN1 (0.44) MEN1KMT2AUSP2KDM1ARCOR1
SCHEMBL27851775 0.75 ALDH1A1 (0.40) MEN1KMT2AUSP2TSHRSMN1; SMN2
SCHEMBL5501909 0.72 GRM8 (0.43) MEN1KMT2AUSP2TSHRSMN1; SMN2
SCHEMBL21396807 0.71 CYP3A4 (0.45) MEN1KMT2AUSP2AHRTSHR

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