SCHEMBL9417030

SCHEMBL9417030

CCCC(F)(F)P(=O)(CCC#N)OCC

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ACHE P22303 1/20 0.33
TSHR P16473 1/20 0.31

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
SCHEMBL9416951 0.75 GABBR2 (0.38) MEN1KMT2ATSHR
SCHEMBL9336342 0.73 ACHE (0.34) MEN1KMT2AACHETSHR
SCHEMBL9359445 0.70 ACHE (0.39) MEN1KMT2AACHETSHR
SCHEMBL15041913 0.69 TSHR (0.40) TSHR
SCHEMBL491513 0.69 TSHR (0.54) MEN1KMT2AACHETSHR
SCHEMBL7790759 0.67 TSHR (0.41) MEN1KMT2AACHETSHR
SCHEMBL9063517 0.67 TSHR (0.43) MEN1KMT2AACHETSHR
SCHEMBL11726422 0.66 PPARD (0.57) MEN1KMT2AACHETSHR
SCHEMBL8971494 0.66 ACHE (0.36) MEN1KMT2AACHETSHR
SCHEMBL19398541 0.65 TSHR (0.48) MEN1KMT2AACHETSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5300679-A Antagonists to 4-aminobutyric acid CIBA-GEIGY CORPORATION (US) 1994-04-05 US disclosed
US-5190933-A Treatment of cognitive and memory disorders CIBA-GEIGY CORPORATION (US) 1993-03-02 US disclosed
US-5064819-A Antidepressants, anxiolytic agents, GABA antagonists CIBA-GEIGY CORPORATION (US) 1991-11-12 US disclosed
US-5051524-A Treatment of a phosphinic acid with an anhydrous protic medium CIBA-GEIGY CORPORATION (US) 1991-09-24 US disclosed
US-5013863-A Learning enhancement CIBA-GEIGY CORPORATION (US) 1991-05-07 US disclosed