SCHEMBL5569878

SCHEMBL5569878

COc1cccc(P(c2ccccc2)c2ccccc2)c1-c1c(Br)cccc1P(C1CCCCC1)C1CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
ROCK2 O75116 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.30
ABCB1 P08183 1/20 0.30
DRD1 P21728 1/20 0.30
ALOX15 P16050 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
SCHEMBL8149220 0.93 ROCK2 (0.36) ROCK2SMN1; SMN2ABCB1DRD1ALOX15
SCHEMBL5573142 0.85 CA1 (0.36) DRD1TSHR
SCHEMBL5569818 0.85 SMN1; SMN2 (0.34) ROCK2SMN1; SMN2ABCB1DRD1TSHR
SCHEMBL4443108 0.85 SMN1; SMN2 (0.34) ROCK2SMN1; SMN2ABCB1DRD1TSHR
SCHEMBL5897015 0.83 ABCB1 (0.40) ROCK2SMN1; SMN2ABCB1
SCHEMBL30217868 0.83 ABCB1 (0.40) ROCK2SMN1; SMN2ABCB1
SCHEMBL5569955 0.82 POLB (0.33) POLBABCB1
SCHEMBL4454435 0.82 SMN1; SMN2 (0.35) POLBSMN1; SMN2ABCB1TSHR
SCHEMBL9177307 0.81 POLL (0.39) ROCK2SMN1; SMN2ABCB1ALOX15TSHR
SCHEMBL5674190 0.78 POLL (0.39) ABCB1ALOX15

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-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
EP-1609795-A1 Process for the preparation of asymmetrically substituted biaryldiphosphines Lonza AG (CH) 2005-12-28 EP disclosed