SCHEMBL5501786

SCHEMBL5501786

CCC1c2ccccc2Oc2cccc(N(C)C)c21

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
USP2 O75604 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CYP1A2 P05177 2/20 0.37
CYP2D6 P10635 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
HTR2A P28223 4/20 0.37
HTR2C P28335 4/20 0.37
HRH1 P35367 2/20 0.37
GRM8 O00222 2/20 0.36
GRM7 Q14831 2/20 0.36
GRM4 Q14833 1/20 0.36
CYP2C19 P33261 1/20 0.34
PKM P14618 1/20 0.34

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
SCHEMBL3905870 0.83 GRM2 (0.41) MEN1KMT2AUSP2L3MBTL1TSHR
SCHEMBL7116333 0.80 MEN1 (0.41) MEN1KMT2AUSP2L3MBTL1TSHR
SCHEMBL1077580 0.78 MAOA (0.52) MEN1KMT2AUSP2L3MBTL1TSHR
SCHEMBL29737271 0.78 MAOA (0.52) MEN1KMT2AUSP2L3MBTL1TSHR
SCHEMBL28023534 0.78 MEN1 (0.37) MEN1KMT2AUSP2L3MBTL1TSHR
SCHEMBL5501565 0.74 AHR (0.40) MEN1KMT2AUSP2MAOAMAOB
SCHEMBL5495275 0.73 KMT2A (0.44) MEN1KMT2AUSP2L3MBTL1TSHR
SCHEMBL5501909 0.72 GRM8 (0.43) MEN1KMT2AUSP2L3MBTL1TSHR
SCHEMBL3898900 0.70 CYP2C9 (0.47) MEN1KMT2AUSP2L3MBTL1TSHR
SCHEMBL22992500 0.68 KMT2A (0.41) MEN1KMT2AUSP2L3MBTL1TSHR

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