SCHEMBL11212059

SCHEMBL11212059

N#Cc1nc(N)sc1[N+](=O)[O-]

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.37
ALDH1A1 P00352 5/20 0.37
TDP1 Q9NUW8 2/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
HPGD P15428 3/20 0.36
ALOX15 P16050 1/20 0.36
MYC P01106 1/20 0.36
WDR5 P61964 1/20 0.36
GAA P10253 2/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
USP8 P40818 2/20 0.33
PKM P14618 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LMNA P02545 1/20 0.32
ALOX12 P18054 1/20 0.32

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
SCHEMBL9762512 0.75 ALDH1A1 (0.41) MAPTALDH1A1TDP1CYP3A4TSHR
SCHEMBL10781893 0.74 ALDH1A1 (0.43) MAPTALDH1A1TDP1CYP3A4TSHR
SCHEMBL25063183 0.72 MAPT (0.39) MAPTALDH1A1TDP1CYP3A4TSHR
SCHEMBL958749 0.72 NOS1 (0.46) MAPTALDH1A1TDP1CYP3A4TSHR
SCHEMBL375913 0.72 ALDH1A1 (0.42) MAPTALDH1A1TDP1CYP3A4TSHR
SCHEMBL27671733 0.72 MAPT (0.39) MAPTALDH1A1TDP1CYP3A4TSHR
SCHEMBL5150808 0.70
SCHEMBL5537146 0.69 KDM4E (0.34) MAPTALDH1A1CYP3A4HPGDUSP8
SCHEMBL9761304 0.68 GAA (0.37) MAPTALDH1A1TDP1CYP3A4TSHR
SCHEMBL19435550 0.68 LMNA (0.41) MAPTALDH1A1TDP1CYP3A4TSHR

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
US-4313872-A MONDAZO AND DISAZO DYES CASSELLA AKTIENGESELLSCHAFT (DE) 1982-02-02 US disclosed
US-4252530-A USING A BASE AS DISCHARGE AGENT IN A DISCHARGE RESIST PASTE AND HEATING CASSELLA AKTIENGESELLSCHAFT (DE) 1981-02-24 US disclosed