SCHEMBL28051432

SCHEMBL28051432

Cc1c(N=O)cc(N=O)cc1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
TDP1 Q9NUW8 3/20 0.40
KDM4E B2RXH2 3/20 0.40
PDE4A P27815 1/20 0.36
BLVRB P30043 1/20 0.36
KDR P35968 1/20 0.36
HTT P42858 1/20 0.36
HSP90AA1 P07900 2/20 0.34
THRB P10828 2/20 0.34
GAA P10253 2/20 0.34
PSMD14 O00487 1/20 0.34
MMP2 P08253 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HPGD P15428 2/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL28051550 0.83
SCHEMBL28191051 0.83 ALDH1A1 (0.35) TDP1KDM4EHTTGAAMAPT
SCHEMBL13447905 0.79 MEN1 (0.39) MEN1KMT2ATDP1KDM4EHSP90AA1
SCHEMBL28157780 0.79 MEN1 (0.39) MEN1KMT2ATDP1KDM4EHSP90AA1
SCHEMBL28230091 0.79 MEN1 (0.39) MEN1KMT2ATDP1KDM4EPDE4A
SCHEMBL19621007 0.79 MEN1 (0.45) MEN1KMT2ATDP1KDM4EHSP90AA1
SCHEMBL14648592 0.79 ALDH1A1 (0.32) HTTMAPK1ALDH1A1LMNAHSD17B10
SCHEMBL6753802 0.78 MEN1 (0.46) MEN1KMT2ATDP1PDE4ABLVRB
SCHEMBL31268708 0.78 MEN1 (0.46) MEN1KMT2ATDP1PDE4ABLVRB
SCHEMBL28165667 0.75 RXRA (0.45) KDM4EHPGDALDH1A1NOTUMHSD17B10

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-105906523-B The synthetic method of one bulb dysentery spirit 浙江荣耀生物科技股份有限公司 2018-01-02 CN claimed
CN-105906523-B The synthetic method of one bulb dysentery spirit 浙江荣耀生物科技股份有限公司 2018-01-02 CN disclosed
CN-206560862-U A kind of separate space reaction unit synthesized for dinitolmide 韶关市新科农生物科技有限公司 2017-10-17 CN disclosed
CN-104311448-B A kind of preparation method of dinitolmide 浙江汇能动物药品有限公司 2016-06-08 CN disclosed