SCHEMBL10366017

SCHEMBL10366017

CCOC(=O)Cn1c(=O)sc2cc(F)c([N+](=O)[O-])cc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 3/20 0.41
MITF O75030 1/20 0.41
ALDH1A1 P00352 6/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
RXFP1 Q9HBX9 2/20 0.40
KDM4E B2RXH2 2/20 0.40
GRIA1 P42261 1/20 0.40
GRIA2 P42262 1/20 0.40
GRIA3 P42263 1/20 0.40
GRIA4 P48058 1/20 0.40
POLB P06746 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
HPGD P15428 1/20 0.39
HK1 P19367 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
SCHEMBL11110740 0.87 MEN1 (0.42) SMN1; SMN2MEN1KMT2AMAPTMITF
SCHEMBL11105233 0.85 POLB (0.47) SMN1; SMN2MEN1KMT2AMAPTMITF
SCHEMBL10365806 0.82 ALDH1A1 (0.43) SMN1; SMN2MEN1KMT2AALDH1A1RXFP1
SCHEMBL10365714 0.80 MAPK1 (0.38) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL9489658 0.78 RXFP1 (0.51) SMN1; SMN2MEN1KMT2AMAPTMITF
SCHEMBL8192778 0.77 GRIA1 (0.61) GRIA1GRIA2GRIA3GRIA4
SCHEMBL11102330 0.77 APOBEC3A (0.53) MAPTALDH1A1RXFP1KDM4EPOLB
SCHEMBL11104339 0.75 ALDH1A1 (0.45) MEN1KMT2AALDH1A1RXFP1KDM4E
SCHEMBL7802413 0.75 GRIA1 (0.64) GRIA1GRIA2GRIA3GRIA4
SCHEMBL10365355 0.75 GRM7 (0.39) KDM4ETDP1

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-0218972-B1 BENZOTHIAZOLONES, AND THEIR PRODUCTION AND USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-02-07 EP disclosed
US-4888428-A HERBICIDE INTERMEDIATES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-12-19 US disclosed
US-4720297-A Benzothiazolones, and their production and use as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-01-19 US disclosed
EP-0218972-A1 Benzothiazolones, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-04-22 EP disclosed