SCHEMBL2555038

SCHEMBL2555038

CCCC(C)P(c1ccccc1P(C(C)CCC)C(C)CCC)C(C)CCC

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 2/20 0.33
AOC3 Q16853 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
FFAR1 O14842 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
SIGMAR1 Q99720 1/20 0.31
MME P08473 1/20 0.30
TSHR P16473 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
SCHEMBL2548356 0.88 TSHR (0.33) SMN1; SMN2POLBTSHR
SCHEMBL2551637 0.83 ALDH1A1 (0.35) SIGMAR1
SCHEMBL2879053 0.83 KDM4E (0.38) SMN1; SMN2NPC1RAB9A
SCHEMBL2549497 0.83 TSHR (0.41) TSHR
SCHEMBL2550791 0.80 SMN1; SMN2 (0.38) SMN1; SMN2POLBAOC3NPC1RAB9A
SCHEMBL2545862 0.77 TRPM4 (0.35) SMN1; SMN2FFAR1GPR84TSHR
SCHEMBL2879726 0.76
SCHEMBL2558969 0.74 TSHR (0.33) SMN1; SMN2TSHR
SCHEMBL2552650 0.72 CA12 (0.33) SMN1; SMN2
SCHEMBL2551261 0.72 ALDH1A1 (0.41) POLBTSHR

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 3 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
EP-1354886-A1 Process for the preparation of tertiary phosphines Bayer Aktiengesellschaft (DE) 2003-10-22 EP disclosed