SCHEMBL9070899

SCHEMBL9070899

CCCCCOc1cc(C(=O)Nc2ncc(C)s2)cc(OC)n1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.49
NPC1 O15118 7/20 0.49
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 4/20 0.47
ALDH1A1 P00352 4/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
POLB P06746 1/20 0.45
MITF O75030 1/20 0.43
ALOX12 P18054 1/20 0.43
MAPK10 P53779 1/20 0.43
PAX8 Q06710 1/20 0.43
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL9070898 0.81 SMN1; SMN2 (0.56) RAB9ANPC1LMNASMN1; SMN2ALDH1A1
SCHEMBL9070900 0.80 RAB9A (0.55) RAB9ANPC1LMNASMN1; SMN2ALDH1A1
SCHEMBL2667943 0.79 NPC1 (0.54) RAB9ANPC1LMNASMN1; SMN2ALDH1A1
SCHEMBL2667941 0.79 NPC1 (0.57) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL9070896 0.76 HCAR3 (0.52)
SCHEMBL13870307 0.74 ALDH1A1 (0.55) RAB9ANPC1LMNASMN1; SMN2ALDH1A1
SCHEMBL2664773 0.73 ALDH1A1 (0.59) RAB9ANPC1LMNASMN1; SMN2ALDH1A1
SCHEMBL12742436 0.71 SMN1; SMN2 (0.66) RAB9ANPC1LMNASMN1; SMN2ALDH1A1
SCHEMBL2667942 0.71 RAB9A (0.62) RAB9ANPC1LMNASMN1; SMN2ALDH1A1
SCHEMBL10253052 0.69 SMN1; SMN2 (0.65) RAB9ALMNASMN1; SMN2MAPK10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009083553-A1 AZINE COMPOUNDS AS GLUCOKINASE ACTIVATORS RHEOSCIENCE A/S (DK) 2009-07-09 WO disclosed