SCHEMBL2401634

SCHEMBL2401634

O=CC(O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.60
POLB P06746 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.54
RAB9A P51151 1/20 0.48
CHRNB2 P17787 3/20 0.46
CHRNA4 P43681 3/20 0.46
CHRNB4 P30926 2/20 0.46
CHRNA3 P32297 2/20 0.46
TGM2 P21980 4/20 0.40
TDP1 Q9NUW8 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL27765218 0.85 MAPT (0.60) MAPTPOLBSMN1; SMN2RAB9ACHRNB2
SCHEMBL611770 0.81 MAPT (0.67) MAPTPOLBSMN1; SMN2RAB9ACHRNB2
SCHEMBL27765211 0.80 MAPT (0.60) MAPTPOLBSMN1; SMN2RAB9ACHRNB2
SCHEMBL19748624 0.79 MAPT (0.53) MAPTPOLBSMN1; SMN2RAB9ACHRNB2
SCHEMBL16625907 0.78 MAPT (0.58) MAPTPOLBSMN1; SMN2RAB9ACHRNB2
SCHEMBL29435521 0.77 MAPT (0.97) MAPTPOLBSMN1; SMN2RAB9ACHRNB2
SCHEMBL15141576 0.77 MAPT (0.97) MAPTPOLBSMN1; SMN2RAB9ACHRNB2
SCHEMBL3539759 0.77 MAPT (0.90) MAPTPOLBSMN1; SMN2RAB9ACHRNB2
SCHEMBL521907 0.76 MAPT (0.72) MAPTPOLBSMN1; SMN2RAB9ACHRNB2
SCHEMBL21275401 0.76 MAPT (0.63) MAPTPOLBSMN1; SMN2RAB9ACHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2545052-A1 IMIDAZOPYRIDINES SYK INHIBITORS Gilead Connecticut, Inc. (US) 2013-01-16 EP disclosed
WO-2011112995-A1 IMIDAZOPYRIDINES SYK INHIBITORS GILEAD SCIENCES, INC. (US) 2011-09-15 WO disclosed