SCHEMBL8078574

SCHEMBL8078574

CCCCCCCCCCCCCCCCCC(=O)NC(=O)OC(C)c1cc(C)c(C)cc1[N+](=O)[O-]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 4/20 0.40
LMNA P02545 3/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
RECQL P46063 1/20 0.38
MAPT P10636 1/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
ESR1 P03372 1/20 0.37
NPY1R P25929 1/20 0.36
NPY2R P49146 1/20 0.36

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
SCHEMBL8079834 0.87 GAA (0.42) GAAHPGDALDH1A1LMNACYP3A4
SCHEMBL8082873 0.83 GAA (0.51) GAAHPGDALDH1A1LMNACYP3A4
SCHEMBL8078635 0.76 GAA (0.52) GAAHPGDALDH1A1LMNACYP3A4
SCHEMBL25932835 0.70 SIRT3 (0.48) ALDH1A1CYP3A4KMT2A
SCHEMBL28665262 0.70 LMNA (0.59) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL28836129 0.70 LMNA (0.59) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL18161131 0.69 ALDH1A1 (0.46) HPGDALDH1A1LMNAKDM4EMEN1
SCHEMBL3619558 0.68 MGLL (0.51) GAAHPGDALDH1A1LMNAMEN1
SCHEMBL8079881 0.68 KMT2A (0.53) GAAHPGDALDH1A1LMNACYP3A4
SCHEMBL27889292 0.66 CTSL (0.47) GAAHPGDALDH1A1LMNACYP3A4

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
US-6087072-A Article having a light-controllable super-water-repellent surface and a printing machine using the article HITACHI, LTD. (JP) 2000-07-11 US disclosed
US-6027852-A Article having a light-controllable super-water-repellent surface and a printing machine using the article HITACHI, LTD. (JP) 2000-02-22 US disclosed