SCHEMBL9501495

SCHEMBL9501495

CC1(C)CC(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC(C)(C)N1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.65
KMT2A Q03164 2/20 0.65
L3MBTL1 Q9Y468 2/20 0.65
GLA P06280 1/20 0.58
CYP2C9 P11712 1/20 0.55
POLB P06746 1/20 0.53
EZH2 Q15910 5/20 0.53
ALDH1A1 P00352 1/20 0.51
HSP90AA1 P07900 1/20 0.51
HPGD P15428 1/20 0.51
ALOX5 P09917 1/20 0.51
MITF O75030 1/20 0.50
RAD52 P43351 1/20 0.50
VCAM1 P19320 1/20 0.50

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
SCHEMBL7038879 0.87 GLA (0.70) MEN1KMT2AL3MBTL1GLACYP2C9
SCHEMBL9501514 0.83 ALDH1A1 (0.48) MEN1KMT2APOLBALDH1A1HSP90AA1
SCHEMBL2224151 0.82 VCAM1 (0.65) MEN1KMT2APOLBALDH1A1HSP90AA1
SCHEMBL7040302 0.81 L3MBTL1 (0.76) MEN1KMT2AL3MBTL1GLACYP2C9
SCHEMBL9503355 0.81 MEN1 (0.71) MEN1KMT2AL3MBTL1GLACYP2C9
SCHEMBL7039061 0.80 L3MBTL1 (0.77) MEN1KMT2AL3MBTL1GLACYP2C9
SCHEMBL6120920 0.79 MEN1 (0.77) MEN1KMT2AL3MBTL1GLACYP2C9
SCHEMBL11843656 0.79 L3MBTL1 (1.00) MEN1KMT2AL3MBTL1GLACYP2C9
SCHEMBL169747 0.78 EZH2 (0.80) MEN1KMT2AL3MBTL1GLACYP2C9
Hydrochloric Acid SCHEMBL11842228 0.78 L3MBTL1 (0.97) MEN1KMT2AL3MBTL1GLACYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0241419-B1 PIGMENTS CONTAINING PIPERIDYL GROUPS SANDOZ AG (CH) 1993-05-19 EP disclosed
US-4866113-A COLORING POLYMERS SANDOZ LTD. (CH) 1989-09-12 US disclosed
US-4838943-A Compounds useful as pigments containing one or more 2,2,6,6-tetraalkylpiperidine groups SANDOZ LTD. (CH) 1989-06-13 US disclosed
EP-0241419-A2 Pigments containing piperidyl groups SANDOZ AG (CH) 1987-10-14 EP disclosed