SCHEMBL8079834

SCHEMBL8079834

CCCCCCCCCCCCCCCCCC(=O)NC(=O)OC(C)c1ccc(C)cc1[N+](=O)[O-]

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.42
HPGD P15428 1/20 0.42
TDP1 Q9NUW8 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 2/20 0.41
MAPK1 P28482 1/20 0.41
ALDH1A1 P00352 5/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
CYP2C9 P11712 3/20 0.40
CYP3A4 P08684 3/20 0.40
CYP2D6 P10635 2/20 0.40
CYP2C19 P33261 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 2/20 0.39
KDM4E B2RXH2 2/20 0.39
CYP1A2 P05177 3/20 0.39
CRHBP P24387 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
SCHEMBL8078574 0.87 GAA (0.41) GAAHPGDLMNAKMT2AMAPT
SCHEMBL8082873 0.86 GAA (0.51) GAAHPGDLMNAKMT2AMAPT
SCHEMBL8079837 0.76 KAT2B (0.44) GAATDP1MAPTALDH1A1NPC1
SCHEMBL8078635 0.76 GAA (0.52) GAAHPGDLMNAKMT2AMAPT
SCHEMBL23805426 0.74 TSHR (0.49) GAATDP1LMNAALDH1A1NPC1
SCHEMBL28489159 0.72 KMT2A (0.50) GAATDP1L3MBTL1LMNAKMT2A
SCHEMBL9056702 0.70 MGLL (0.51) GAAHPGDLMNAKMT2AALDH1A1
SCHEMBL3619558 0.70 MGLL (0.51) GAAHPGDLMNAKMT2AALDH1A1
SCHEMBL22897856 0.70 TSHR (0.50) GAAHPGDTDP1L3MBTL1LMNA
SCHEMBL11892523 0.70 TSHR (0.53) GAAHPGDTDP1L3MBTL1LMNA

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