SCHEMBL8056519

SCHEMBL8056519

C(=NNc1ccccc1)c1cccc2nnsc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 13/20 0.49
GAA P10253 11/20 0.49
KMT2A Q03164 11/20 0.49
MEN1 O00255 10/20 0.49
ALDH1A1 P00352 6/20 0.49
HPGD P15428 5/20 0.49
GFER P55789 2/20 0.49
RAB9A P51151 11/20 0.46
NPC1 O15118 9/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
SENP7 Q9BQF6 2/20 0.46
CASP3 P42574 1/20 0.46
NOX1 Q9Y5S8 1/20 0.44
KDM4E B2RXH2 6/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
MAPK1 P28482 2/20 0.42
LMNA P02545 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALOX12 P18054 1/20 0.38
POLB P06746 2/20 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
SCHEMBL9172113 0.75 ALOX12 (0.37) MAPTALDH1A1HPGDRAB9ANPC1
SCHEMBL9172116 0.75 ALOX12 (0.37) MAPTALDH1A1HPGDRAB9ANPC1
SCHEMBL8054084 0.72 ADRA1D (0.33)
SCHEMBL543477 0.70 CYP2A6 (0.43) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL3081631 0.67 MEN1 (0.69) MAPTGAAKMT2AMEN1ALDH1A1
SCHEMBL16218024 0.67 MEN1 (0.69) MAPTGAAKMT2AMEN1ALDH1A1
SCHEMBL734790 0.66 KMT2A (1.00) MAPTGAAKMT2AMEN1ALDH1A1
SCHEMBL3065879 0.66 MAPT (0.62) MAPTGAAKMT2AMEN1ALDH1A1
SCHEMBL6714200 0.66 MAPT (0.62) MAPTGAAKMT2AMEN1ALDH1A1
SCHEMBL6714202 0.66 MAPT (0.62) MAPTGAAKMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0502473-B1 Microbicidal benzo-1,2,3-thiadiazole derivatives NOVARTIS AG (CH) 2000-04-26 EP disclosed
US-5384321-A Benzothiadiazole compounds CIBA-GEIGY CORPORATION (US) 1995-01-24 US disclosed
US-5260423-A Fungicide, viricide or bactericide CIBA-GEIGY CORPORATION (US) 1993-11-09 US disclosed
EP-0502473-A1 Microbicidal benzo-1,2,3-thiadiazole derivatives CIBA-GEIGY AG (CH) 1992-09-09 EP disclosed