Calcium

Calcium

SCHEMBL9561192

OC(CC(O)C(F)(F)F)C(F)(F)F.OC(CC(O)C(F)(F)F)C(F)(F)F.[Ca]

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CETP P11597 1/20 0.53
PKM P14618 1/20 0.42
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
GAA P10253 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
SCHEMBL459896 0.96 CETP (0.56) CETPPKMLMNAHTTKMT2A
SCHEMBL7181118 0.93 CETP (0.53) CETPPKMLMNAHTTKMT2A
SCHEMBL27683427 0.93 CETP (0.53) CETPPKMLMNAHTTKMT2A
SCHEMBL5859104 0.82 TSHR (0.46) CETPPKMLMNAHTTKMT2A
SCHEMBL21451479 0.82 CETP (0.43) CETPPKMLMNAHTTKMT2A
SCHEMBL7858477 0.82 CETP (0.43) CETPPKMLMNAHTTKMT2A
SCHEMBL28696575 0.80 CETP (0.48) CETPPKMLMNAHTTKMT2A
SCHEMBL12868845 0.78 CETP (0.46) CETPPKMLMNAHTTKMT2A
SCHEMBL7530106 0.78 CETP (0.46) CETPPKMLMNAHTTKMT2A
SCHEMBL1492602 0.78 CETP (0.46) CETPPKMLMNAHTTKMT2A

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-5250740-A Precursors for metal fluoride deposition and use thereof THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1993-10-05 US disclosed
US-5116785-A METHOD OF DEPOSITING METAL FLUORIDE THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITIAN AND NORTHERN IRELAND (GB) 1992-05-26 US disclosed