SCHEMBL9044759

SCHEMBL9044759

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

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
MAPT P10636 1/20 0.52
MAOB P27338 2/20 0.51
HTT P42858 1/20 0.49
HTR2A P28223 1/20 0.49
RAB9A P51151 1/20 0.49
IDO1 P14902 2/20 0.49
GAA P10253 1/20 0.48
AKR1C3 P42330 1/20 0.48
MAOA P21397 1/20 0.47
POLB P06746 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL10389171 0.85 ALDH1A1 (0.50) ALDH1A1MAPTMAOBHTTHTR2A
SCHEMBL19056380 0.84 ALDH1A1 (0.51) ALDH1A1MAPTMAOBHTTHTR2A
SCHEMBL10390028 0.84 ALDH1A1 (0.46) ALDH1A1MAPTMAOBHTTHTR2A
SCHEMBL11255725 0.83 HTT (0.56) ALDH1A1MAPTMAOBHTTHTR2A
SCHEMBL10569487 0.83 ACHE (0.58) ALDH1A1MAPTMAOBHTTHTR2A
SCHEMBL9976430 0.83 ALDH1A1 (0.55) ALDH1A1MAPTMAOBHTTHTR2A
SCHEMBL6046651 0.83 ALDH1A1 (0.53) ALDH1A1MAPTMAOBHTTHTR2A
SCHEMBL9728624 0.83 ALDH1A1 (0.59) ALDH1A1MAPTHTTHTR2ARAB9A
SCHEMBL9664956 0.82 ALDH1A1 (0.47) ALDH1A1MAPTMAOBHTTHTR2A
SCHEMBL11540661 0.82 ALDH1A1 (0.54) ALDH1A1MAPTMAOBHTTHTR2A

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 16 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-5057523-A Water soluble bactericide ABBOTT LABORATORIES (US) 1991-10-15 US disclosed
US-5057520-A Water solubility 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-4767781-A ANTIDIABETIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-08-30 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