SCHEMBL3342443

SCHEMBL3342443

CC(C)(C)C1=CC=C(O)C(=NCc2ccccn2)C1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.36
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
GAA P10253 1/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
CYP1A2 P05177 1/20 0.33
HRH1 P35367 1/20 0.33
MAP1LC3B Q9GZQ8 1/20 0.32
NPSR1 Q6W5P4 3/20 0.32
CNR2 P34972 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL3342831 0.80 SMN1; SMN2 (0.38) ALDH1A1NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL3347444 0.78 MAP1LC3B (0.37) ALDH1A1NPC1RAB9ASMN1; SMN2GAA
SCHEMBL3341792 0.76 SMN1; SMN2 (0.41) ALDH1A1NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL3342426 0.75 L3MBTL1 (0.38) ALDH1A1NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL3347065 0.71 SMN1; SMN2 (0.40) ALDH1A1NPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL15292881 0.64 CYP1A2 (0.42) ALDH1A1NPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL3347650 0.64 POLB (0.39) ALDH1A1NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL3340989 0.63 ALDH1A1 (0.40) ALDH1A1NPC1RAB9ACYP1A2HRH1
SCHEMBL1043027 0.62 HRH1 (0.54) ALDH1A1SMN1; SMN2L3MBTL1CYP1A2HRH1
SCHEMBL17691642 0.62 SMN1; SMN2 (0.47) ALDH1A1NPC1RAB9ASMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2010550-B1 POLYMERISATION OF ETHYLENE AND ALPHA-OLEFINS WITH PYRIDINO-IMINOPHENOL COMPLEXES TOTAL RES & TECHNOLOGY FELUY (BE) 2013-06-19 EP disclosed
US-8399582-B2 Polymerisation of ethylene and alpha-olefins with pyridino-iminophenol complexes TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2013-03-19 US disclosed
US-20100160583-A1 Polymerisation of Ethylene and Alpha-Olefins with Pyridino-Iminophenol Complexes TOTAL PETROCHEMICALS RESEARCH FEULY (BE) 2010-06-24 US disclosed