SCHEMBL9770834

SCHEMBL9770834

CCCCSNC(=O)NC(=O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
KDM4E B2RXH2 4/20 0.55
CTSD P07339 1/20 0.51
ALDH1A1 P00352 6/20 0.50
LMNA P02545 4/20 0.49
PPIA P62937 1/20 0.49
MAPT P10636 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
ALPL P05186 1/20 0.48
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
GLA P06280 1/20 0.46
RAB9A P51151 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
GAA P10253 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HTT P42858 1/20 0.44

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
SCHEMBL9770719 0.80 MEN1 (0.69) MEN1KMT2AKDM4ECTSDALDH1A1
SCHEMBL9770823 0.79 MEN1 (0.71) MEN1KMT2AKDM4ECTSDALDH1A1
SCHEMBL9770798 0.78 MEN1 (0.70) MEN1KMT2AKDM4ECTSDALDH1A1
SCHEMBL9770714 0.77 LMNA (0.65) MEN1KMT2AKDM4ECTSDALDH1A1
SCHEMBL9770890 0.76 ALDH1A1 (0.56) MEN1KMT2AKDM4ECTSDALDH1A1
SCHEMBL4960015 0.75 HTT (0.69) MEN1KMT2AKDM4ECTSDALDH1A1
SCHEMBL28194182 0.74 MEN1 (0.58) MEN1KMT2AKDM4ECTSDALDH1A1
SCHEMBL5508331 0.74 HTT (0.62) MEN1KMT2AKDM4ECTSDALDH1A1
SCHEMBL9647801 0.73 NAAA (0.63) MEN1KMT2AKDM4ECTSDALDH1A1
SCHEMBL9172165 0.73 NAAA (0.63) MEN1KMT2AKDM4ECTSDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4987135-A Leukemia, melanoma ISHIHARA SANGYO KAISHA LTD. (JP) 1991-01-22 US claimed