SCHEMBL2127668

SCHEMBL2127668

COC(=O)Oc1ccc2nc(-c3ccc([N+](=O)[O-])cc3)cn2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.60
NPC1 O15118 11/20 0.60
MAPT P10636 6/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
ALDH1A1 P00352 11/20 0.59
SMN1; SMN2 Q16637 9/20 0.59
POLB P06746 3/20 0.59
LMNA P02545 2/20 0.59
GAA P10253 2/20 0.59
STAT3 P40763 1/20 0.59
CASP3 P42574 1/20 0.59
SENP7 Q9BQF6 1/20 0.59
SENP6 Q9GZR1 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
APP P05067 2/20 0.55
KDM4E B2RXH2 9/20 0.51
HPGD P15428 5/20 0.51
THRB P10828 1/20 0.48
ALDH1A3 P47895 4/20 0.48

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
SCHEMBL2129500 0.87 RAB9A (0.58) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL2128509 0.86 ALDH1A1 (0.64) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL2127391 0.86 ALDH1A3 (0.66) RAB9ANPC1MAPTKMT2AALDH1A1
SCHEMBL2906717 0.86 RAB9A (0.67) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL2126827 0.83 ALDH1A1 (0.65) RAB9ANPC1MAPTKMT2AALDH1A1
SCHEMBL2129493 0.83 ALDH1A1 (0.55) RAB9ANPC1MAPTALDH1A1SMN1; SMN2
SCHEMBL2127074 0.83 NPC1 (0.56) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL2127814 0.83 NPC1 (0.57) RAB9ANPC1MAPTALDH1A1SMN1; SMN2
SCHEMBL2127666 0.83 NPC1 (0.62) RAB9ANPC1MAPTKMT2AALDH1A1
SCHEMBL2129005 0.83 ALDH1A1 (0.68) RAB9ANPC1MAPTMEN1KMT2A

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
EP-2129375-B1 IMIDAZO[1,2-A]PYRIDINES AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2012-04-25 EP claimed