SCHEMBL9044754

SCHEMBL9044754

CC(C)(CC(=O)OCc1ccc([N+](=O)[O-])cc1)O[C]=O

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.53
▸ MAPT P10636 1/20 0.53
▸ GAA P10253 1/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ HTT P42858 1/20 0.44
▸ HTR2A P28223 1/20 0.44
▸ IDO1 P14902 1/20 0.43
▸ MAOB P27338 1/20 0.43

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
SCHEMBL5764920 0.81 ALDH1A1 (0.51) ALDH1A1L3MBTL1MAPK1RAB9A
SCHEMBL11109283 0.80 ALDH1A1 (0.47) ALDH1A1GAAL3MBTL1MAPK1RAB9A
SCHEMBL12611640 0.78 MAOB (0.45) ALDH1A1MAPTMAPK1RAB9AHTT
SCHEMBL11058642 0.76 ALDH1A1 (0.46) ALDH1A1L3MBTL1MAPK1RAB9A
SCHEMBL6141237 0.76 ALDH1A1 (0.56) ALDH1A1MAPTGAAL3MBTL1MAPK1
SCHEMBL1555636 0.76 ALDH1A1 (0.59) ALDH1A1MAPTGAAL3MBTL1MAPK1
SCHEMBL11117077 0.75 ALDH1A1 (0.53) ALDH1A1MAPTGAAL3MBTL1MAPK1
SCHEMBL9117739 0.75 RAB9A (0.51) ALDH1A1MAPTGAAL3MBTL1MAPK1
SCHEMBL9976430 0.75 ALDH1A1 (0.55) ALDH1A1MAPTGAAL3MBTL1RAB9A
SCHEMBL9728624 0.75 ALDH1A1 (0.59) ALDH1A1MAPTGAAL3MBTL1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0360258-B1 Amino acid quinoline and naphthyridine derivatives ABBOTT LAB (US) 1996-08-14 — — EP disclosed
EP-0138416-B1 GROWTH HORMONE RELEASE FACTOR ANALOGS ELI LILLY AND COMPANY (US) 1993-04-28 — — EP disclosed
US-5137872-A Administering to animals PITMAN-MOORE, INC. (US) 1992-08-11 — — US disclosed
US-5057520-A Water solubility ABBOTT LABORATORIES (US) 1991-10-15 — — US disclosed
US-5057523-A Water soluble bactericide ABBOTT LABORATORIES (US) 1991-10-15 — — US disclosed
US-RE33699-E Polypeptides having norleucine, asparagine and aspartic acid groups to stimulate the release of Growth Hormone INTERNATIONAL MINERALS & CHEMICAL CORP. (US) 1991-09-24 — — US disclosed
US-4801456-A Growth hormone-releasing factor analogs INTERNATIONAL MINERALS & CHEMICAL CORP. (US) 1989-01-31 — — US disclosed
US-4617149-A ANIMAL GROWTH REGULATORS ELI LILLY AND COMPANY (US) 1986-10-14 — — US disclosed
EP-0138416-A2 Growth hormone release factor analogs ELI LILLY AND COMPANY (US) 1985-04-24 — — EP disclosed
US-4415493-A POTENTIATION; STIMULANTS; POLYPEPTIDES; ANTICARCINOGENIC AGENTS SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1983-11-15 — — US disclosed
EP-0022621-A1 Peptides related to somatostatin, their preparation and pharmaceutical compositions containing them ELI LILLY AND COMPANY (US) 1981-01-21 — — EP disclosed
EP-0011366-A2 Synthetic peptides, their preparation, pharmaceutical formulations containing them and intermediates for their preparation ELI LILLY AND COMPANY (US) 1980-05-28 — — EP disclosed
US-4202802-A PREFERENTIAL INHIBITION OF SCRETION OF GROWTH HORMONE ELI LILLY AND COMPANY (US) 1980-05-13 — — US disclosed
US-4199500-A INHIBITORS OF SECRETION OF GROWTH HORMONE ELI LILLY AND COMPANY (US) 1980-04-22 — — US disclosed
US-4199501-A INHIBITORS OF SECRETION OF GROWTH HORMONE ELI LILLY AND COMPANY (US) 1980-04-22 — — US disclosed
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