SCHEMBL7365542

SCHEMBL7365542

[CH2]CNC(=O)OC(C)(C)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.34
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
MAOA P21397 1/20 0.30
MAOB P27338 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
SCHEMBL14618042 0.82 EPHX1 (0.36) TDP1MEN1GAAKMT2AMAOA
SCHEMBL208786 0.79 TDP1 (0.52) TDP1MEN1GAAKMT2AMAOA
SCHEMBL21375006 0.78 TDP1 (0.41) TDP1MEN1GAAKMT2AMAOA
SCHEMBL21375013 0.76 ACHE (0.52) TDP1MEN1GAAKMT2A
SCHEMBL13686206 0.74 TDP1 (0.33) TDP1
Phosphonic Acid SCHEMBL8156611 0.73 TDP1 (0.37) TDP1MEN1GAAKMT2AMAOA
SCHEMBL14586293 0.72 PTGER1 (0.32)
SCHEMBL23992120 0.72
SCHEMBL9637794 0.72 GAA (0.35) GAA
SCHEMBL9637796 0.71 LDHA (0.33) MEN1GAAKMT2A

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-0021620-A1 Water-soluble peptides affecting gonadal function THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1981-01-07 EP claimed
US-4018726-A [D-Phe6 ]-LH-RH and intermediates therefor SCHALLY ANDREW VICTOR 1977-04-19 US claimed
US-4010125-A [D-Trp6 ]-LH-RH and intermediates therefor SCHALLY ANDREW VICTOR 1977-03-01 US claimed
EP-0624163-A1 CYCLIC CALCITONIN DERIVATIVES AND METHOD FOR THEIR PRODUCTION Smithkline Beecham Farmaceutici S.p.A. (IT) 1994-11-17 EP disclosed
WO-1993015106-A1 CYCLIC CALCITONINE DERIVATIVES AND METHOD FOR THEIR PRODUCTION SMITHKLINE BEECHAM FARMACEUTICI S.P.A. (IT) 1993-08-05 WO disclosed
EP-0098457-B1 (1S,2R,3R)- AND (1R,2S,3S)-NITRILO-1-CARBONYL-3-METHYL-2-OXY-HEPTANES AND -HEPT-5-ENES USEFUL IN THE TOTAL SYNTHESIS OF CYCLOSPORINS AND PROCESSES FOR THEIR PRODUCTION SANDOZ AG (CH) 1987-08-05 EP disclosed
EP-0181121-A2 Novel polypeptide and process for producing the same MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1986-05-14 EP disclosed
US-4554351-A STEREOISOMERS SANDOZ LTD. (CH) 1985-11-19 US disclosed
EP-0098457-A2 (1S,2R,3R)- and (1R,2S,3S)-nitrilo-1-carbonyl-3-methyl-2-oxy-heptanes and -hept-5-enes useful in the total synthesis of cyclosporins and processes for their production SANDOZ AG (CH) 1984-01-18 EP disclosed
EP-0098456-A2 Peptides comprising a (1S,2R,3R)- or (1R,2S,3S)-1-nitrilo-1-carbonyl-3-methyl-2-oxy-heptane or -hept-5-ene residue useful in the total synthesis of cyclosporins, and processes for their production SANDOZ AG (CH) 1984-01-18 EP disclosed
US-4396542-A Method for the total synthesis of cyclosporins, novel cyclosporins and novel intermediates and methods for their production SANDOZ LTD. (CH) 1983-08-02 US disclosed
EP-0047079-A1 Nonapeptides affecting gonadal function THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1982-03-10 EP disclosed
EP-0034567-A2 A method for the total synthesis of cyclosporins and novel cyclosporins SANDOZ AG (CH) 1981-08-26 EP disclosed
EP-0021620-A1 Water-soluble peptides affecting gonadal function THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1981-01-07 EP disclosed
US-4018726-A [D-Phe6 ]-LH-RH and intermediates therefor SCHALLY ANDREW VICTOR 1977-04-19 US disclosed