SCHEMBL2039482

SCHEMBL2039482

CC1(O)CCN(C2CCN(C(=O)O)CC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 13/20 0.39
L3MBTL1 Q9Y468 11/20 0.39
MBTD1 Q05BQ5 4/20 0.39
TP53BP1 Q12888 2/20 0.39
L3MBTL4 Q8NA19 1/20 0.39
HRH3 Q9Y5N1 2/20 0.37
KCNH2 Q12809 1/20 0.37
TP53 P04637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CHRM1 P11229 2/20 0.36

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
SCHEMBL5901102 0.83 L3MBTL3 (0.33) L3MBTL3L3MBTL1HRH3KCNH2
SCHEMBL1427523 0.82 GRM3 (0.38)
SCHEMBL2550326 0.80 L3MBTL3 (0.46) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL27213341 0.80 L3MBTL3 (0.36) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL2862492 0.78 L3MBTL3 (0.58) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL4334091 0.78 L3MBTL3 (0.58) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL2157153 0.77 HPGD (0.49) HRH3CHRM1
SCHEMBL2521200 0.77 HRH3 (0.41) L3MBTL3L3MBTL1HRH3KCNH2
SCHEMBL2856149 0.77 L3MBTL3 (0.51) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL18949269 0.77 KDM4E (0.56) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4

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-2513110-A1 1, 7 - DIAZACARBAZOLES AND THEIR USE IN THE TREATMENT OF CANCER F. Hoffmann-La Roche AG (CH) 2012-10-24 EP disclosed
WO-2011073263-A1 1, 7 - DIAZACARBAZOLES AND THEIR USE IN THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2011-06-23 WO disclosed