SCHEMBL19632073

SCHEMBL19632073

COC(=O)c1ccnc(/C(=N\O)c2ccccc2OC)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.46
ALDH1A1 P00352 5/20 0.46
NPC1 O15118 4/20 0.46
KDM4E B2RXH2 3/20 0.46
ALOX15 P16050 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.45
LMNA P02545 3/20 0.45
KDM6B O15054 1/20 0.43
KDM5C P41229 1/20 0.43
KDM4C Q9H3R0 1/20 0.43
KDM2A Q9Y2K7 1/20 0.43
KDM3A Q9Y4C1 1/20 0.43
GAA P10253 3/20 0.42
HTT P42858 3/20 0.42
HPGD P15428 2/20 0.42
TP53 P04637 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
NPSR1 Q6W5P4 2/20 0.42

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
SCHEMBL19615611 1.00 RAB9A (0.46) RAB9AALDH1A1NPC1KDM4EALOX15
SCHEMBL19631864 0.89 KDM4C (0.48) RAB9AALDH1A1NPC1KDM4ESMN1; SMN2
SCHEMBL19615620 0.89 KDM4C (0.48) RAB9AALDH1A1NPC1KDM4ESMN1; SMN2
SCHEMBL19615821 0.85 RAB9A (0.50) RAB9AALDH1A1NPC1KDM4EALOX15
SCHEMBL19615810 0.83 KDM4E (0.55) RAB9AALDH1A1NPC1KDM4EALOX15
SCHEMBL19631865 0.83 KDM4E (0.55) RAB9AALDH1A1NPC1KDM4EALOX15
SCHEMBL19615942 0.79 CA1 (0.51) RAB9AALDH1A1NPC1KDM4EALOX15
SCHEMBL19629777 0.79 CA1 (0.51) RAB9AALDH1A1NPC1KDM4EALOX15
SCHEMBL19615569 0.79 KDM4E (0.49) RAB9AALDH1A1NPC1KDM4EALOX15
SCHEMBL19632252 0.78 NPC1 (0.52) RAB9AALDH1A1NPC1KDM4EALOX15

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-2017198785-A1 OXIME DERIVATIVES USEFUL AS INHIBITORS OF HISTONE DEMETHYLASE KDM4C IEO - ISTITUTO EUROPEO DI ONCOLOGIA S.R.L. (IT) 2017-11-23 WO disclosed