SCHEMBL28117652

SCHEMBL28117652

Cc1ccccn1.O=[N+]([O-])c1cccnc1SS

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
MAPT P10636 5/20 0.48
L3MBTL1 Q9Y468 2/20 0.46
ALDH1A1 P00352 4/20 0.46
PKM P14618 1/20 0.46
PDE10A Q9Y233 1/20 0.43
LMNA P02545 1/20 0.43
PAX8 Q06710 1/20 0.43
HSD17B10 Q99714 1/20 0.42
POLB P06746 2/20 0.42
MAPK1 P28482 1/20 0.41
RAB9A P51151 3/20 0.41
HTT P42858 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NPC1 O15118 1/20 0.39

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
SCHEMBL70296 0.89 MEN1 (0.58) GAASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL4988971 0.76 SMN1; SMN2 (0.61) GAASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL6849222 0.76 MEN1 (0.71) GAASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL29627490 0.76 MEN1 (0.61) GAASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL70297 0.76 MEN1 (0.61) GAASMN1; SMN2MEN1KMT2AMAPT
2-Nitrobenzaldehyde SCHEMBL11371001 0.75 ERN1 (0.47) GAASMN1; SMN2MEN1KMT2AMAPT
Nitric Acid SCHEMBL20184220 0.73 ALDH1A1 (0.42) GAASMN1; SMN2MEN1KMT2AMAPT
Nitric Acid SCHEMBL27001587 0.73 ALDH1A1 (0.42) GAASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL13402273 0.73 L3MBTL1 (0.58) GAASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL31676628 0.73 SMN1; SMN2 (0.58) GAASMN1; SMN2MEN1KMT2AMAPT

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
CN-108486086-A Dextranase, encode they nucleic acid and preparation and use their method 维莱尼姆公司 2018-09-04 CN disclosed
CN-103484486-B Dextranase, encode they nucleic acid and preparation and use their method 维莱尼姆公司 2018-04-24 CN disclosed
CN-103484485-B Dextranase, encode they nucleic acid and preparation and use their method BP法人北美有限公司 2017-08-15 CN disclosed
CN-106222185-A Glucanase, the nucleic acid encoding them and preparation and their method of use 维莱尼姆公司 2016-12-14 CN disclosed