SCHEMBL28095503

SCHEMBL28095503

O=[N+]([O-])C(CO)C(C(O)C(O)O)[N+](=O)[O-]

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.30

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
SCHEMBL9979302 0.73 ALDH1A1 (0.33)
SCHEMBL3968801 0.73 LMNA (0.36) LMNA
SCHEMBL767030 0.71
SCHEMBL28272450 0.71
SCHEMBL11499452 0.71
Water SCHEMBL28322585 0.70 TDP1 (0.35)
SCHEMBL6324979 0.68 THRB (0.35)
SCHEMBL19100150 0.68
SCHEMBL10716607 0.68 ALDH1A1 (0.39) LMNA
SCHEMBL28001029 0.67 ALDH1A1 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103641669-B Prepared by a kind of phase stable ammonium nitrate organic additive and phase stable ammonium nitrate thereof 南京理工大学 2016-09-21 CN claimed
CN-103641669-B Prepared by a kind of phase stable ammonium nitrate organic additive and phase stable ammonium nitrate thereof 南京理工大学 2016-09-21 CN disclosed