SCHEMBL2544485

SCHEMBL2544485

CCCCCP(CCCCC)c1ccc(F)cc1F

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GCGR P47871 1/20 0.34
ICMT O60725 3/20 0.33
GHSR Q92847 1/20 0.33
PSMD14 O00487 1/20 0.33
HSP90AA1 P07900 1/20 0.33
MMP2 P08253 1/20 0.33
MC4R P32245 1/20 0.33
RAD52 P43351 1/20 0.33
HTR7 P34969 1/20 0.33
ALDH1A1 P00352 1/20 0.32
CNR1 P21554 2/20 0.32
CNR2 P34972 2/20 0.32
FAAH O00519 1/20 0.32

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
SCHEMBL5716153 0.97 GHSR (0.35) GCGRICMTGHSRPSMD14HSP90AA1
SCHEMBL6786630 0.97 GHSR (0.35) GCGRICMTGHSRPSMD14HSP90AA1
SCHEMBL6786145 0.95 ICMT (0.34) GCGRICMTGHSRPSMD14HSP90AA1
SCHEMBL6793753 0.92 ICMT (0.34) GCGRICMTGHSRPSMD14HSP90AA1
SCHEMBL5715999 0.92 ICMT (0.34) GCGRICMTGHSRPSMD14HSP90AA1
SCHEMBL6792568 0.91 CES2 (0.32) GCGRICMTGHSRHTR7ALDH1A1
SCHEMBL5715633 0.88 HTR7 (0.32) GCGRICMTGHSRHTR7ALDH1A1
SCHEMBL5715807 0.87 CES2 (0.36) ALDH1A1
SCHEMBL5715791 0.84 GHSR (0.35) GCGRICMTGHSRPSMD14HSP90AA1
SCHEMBL5715614 0.81 ICMT (0.34) ICMTGHSRPSMD14HSP90AA1MMP2

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
EP-2552928-A1 A PROCESS FOR THE REDUCTION OF A TERTIARY PHOSPHINE OXIDE TO THE CORRESPONDING TERTIARY PHOSPHINE IN THE PRESENCE OF A CATALYST AND USE OF A TERTIARY PHOSPHINE FOR REDUCING A TERTIARY PHOSPHINE OXIDE IN THE PRESENCE OF A CATALYST Chromafora AB (SE) 2013-02-06 EP disclosed
WO-2011123037-A1 A PROCESS FOR THE REDUCTION OF A TERTIARY PHOSPHINE OXIDE TO THE CORRESPONDING TERTIARY PHOSPHINE IN THE PRESENCE OF A CATALYST AND USE OF A TERTIARY PHOSPHINE FOR REDUCING A TERTIARY PHOSPHINE OXIDE IN THE PRESENCE OF A CATALYST CHROMAFORA AB (SE) 2011-10-06 WO disclosed