SCHEMBL3783182

SCHEMBL3783182

O=C(O)CC(=O)Cc1ncc[nH]1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 2/20 0.51
GAA P10253 5/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HTT P42858 4/20 0.45
KDM4E B2RXH2 3/20 0.45
TAAR1 Q96RJ0 5/20 0.43
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
FDPS P14324 1/20 0.41
FPR2 P25090 1/20 0.40
TERT O14746 1/20 0.40
ALOX15 P16050 1/20 0.39
HTR1A P08908 1/20 0.37

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
SCHEMBL8519473 0.86 TBXAS1 (0.50) TBXAS1GAASMN1; SMN2HTTKDM4E
Imidazoleacetic Acid SCHEMBL360337 0.84
Imidazoleacetic Acid SCHEMBL2172193 0.82 TBXAS1 (0.59) TBXAS1GAASMN1; SMN2HTTKDM4E
Imidazoleacetic Acid SCHEMBL15007471 0.82 TBXAS1 (0.56) TBXAS1GAASMN1; SMN2HTTKDM4E
Imidazoleacetic Acid SCHEMBL17375738 0.82 TBXAS1 (0.56) TBXAS1GAASMN1; SMN2HTTKDM4E
Imidazoleacetic Acid SCHEMBL2827600 0.81 TBXAS1 (0.54) TBXAS1GAASMN1; SMN2HTTKDM4E
SCHEMBL9805578 0.79 TBXAS1 (0.45) TBXAS1GAASMN1; SMN2HTTKDM4E
SCHEMBL7570268 0.79 TAAR1 (0.49) TBXAS1GAASMN1; SMN2HTTKDM4E
SCHEMBL18985083 0.79 TBXAS1 (0.45) TBXAS1GAASMN1; SMN2HTTKDM4E
Imidazoleacetic Acid SCHEMBL28462628 0.78 TBXAS1 (0.51) TBXAS1GAASMN1; SMN2HTTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9364437-B2 Diaminooxidase-containing pharmaceutical compositions SCIOTEC DIAGNOSTIC TECHNOLOGIES GMBH (AT) 2016-06-14 US disclosed
US-20140220148-A1 DIAMINOOXIDASE-CONTAINING PHARMACEUTICAL COMPOSITIONS SCIOTEC DIAGNOSTIC TECHNOLOGIES GMBH (AT) 2014-08-07 US disclosed
US-8716244-B2 Diaminooxidase-containing pharmaceutical compositions SCIOTEC DIAGNOSTIC TECHNOLOGIES GMBH (AT) 2014-05-06 US disclosed
US-20100330191-A1 DIAMINOOXIDASE-CONTAINING PHARMACEUTICAL COMPOSITIONS STADA ARZNEIMITTEL AG (DE) 2010-12-30 US disclosed
US-20080193491-A1 Foods, cosmetics; for treating histamine-induced disease; hydrogel, gastric-juice-resistant pellet SCIOTEC DIAGNOSTIC TECHNOLOGIES GMBH (AT) 2008-08-14 US disclosed