SCHEMBL9738701

SCHEMBL9738701

CC(C)(C)OC(=O)C(O[C]=O)C(Cl)(Cl)Cl

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL18222484 0.76 LMNA (0.34) LMNAKMT2A
SCHEMBL6716735 0.74 CTSK (0.33) LMNAKMT2A
SCHEMBL11399906 0.74
SCHEMBL3883972 0.74 CA12 (0.33) LMNAKMT2A
SCHEMBL2992403 0.73 CTSS (0.34)
SCHEMBL7667953 0.73 CYP3A4 (0.33)
SCHEMBL2086712 0.71 CA1 (0.33) LMNAKMT2A
SCHEMBL7611022 0.68
SCHEMBL7381837 0.68 KMT2A (0.39) LMNAKMT2A
SCHEMBL198657 0.67 CTSK (0.37) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9828341-B2 Dendritic core compounds VICTORIA LINK LIMITED (NZ) 2017-11-28 US claimed
US-5132421-A 2-naphthyl-carbapenem intermediates MERCK & CO., INC. (US) 1992-07-21 US claimed
EP-0053961-B1 THIOVINYL-3-CEPHALOSPORIN DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM RHONE-POULENC SANTE (FR) 1984-10-24 EP claimed
US-4014874-A Process for the manufacture of 3-substituted thiomethyl-7-amino-2-cephem-4-carboxylic acid compound CIBA-GEIGY CORPORATION (US) 1977-03-29 US disclosed