SCHEMBL5572903

SCHEMBL5572903

COc1ccccc1C1C(P(C2CCCCC2)C2CCCCC2)=CC=CC1(Br)P(c1ccccc1)c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HTR2C P28335 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
MCOLN2 Q8IZK6 1/20 0.31
MCOLN3 Q8TDD5 1/20 0.31
MCOLN1 Q9GZU1 1/20 0.31
TACR1 P25103 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
SCHEMBL15967700 0.69
SCHEMBL6137485 0.68 MEN1 (0.36) MEN1KMT2AHTR2CL3MBTL1
SCHEMBL6137738 0.66 HSD11B1 (0.34) MEN1KMT2AHTR2CL3MBTL1
SCHEMBL16719320 0.66 HSD11B1 (0.34) MEN1KMT2AHTR2CL3MBTL1
SCHEMBL6651864 0.66 SMN1; SMN2 (0.42) KMT2AHTR2C
SCHEMBL29527648 0.66 SMN1; SMN2 (0.42) KMT2AHTR2C
SCHEMBL16694568 0.64 CA1 (0.43) HTR2C
SCHEMBL29527801 0.64 CA1 (0.43) HTR2C
SCHEMBL8149220 0.63 ROCK2 (0.36)
SCHEMBL30829086 0.63 CA1 (0.41) MEN1KMT2AHTR2C

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-1761548-A1 PROCESS FOR THE PREPARATION OF ASYMMETRICALLY SUBSTITUTED BIARYLDIPHOSPHINES LONZA AG (CH) 2007-03-14 EP disclosed
WO-2006002729-A1 PROCESS FOR THE PREPARATION OF ASYMMETRICALLY SUBSTITUTED BIARYLDIPHOSPHINES LONZA AG (CH) 2006-01-12 WO disclosed