SCHEMBL29952149

SCHEMBL29952149

Cc1ccc(B(O)O)c(-c2c(F)c(F)c(F)c(F)c2F)n1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 1/20 0.32
CCR1 P32246 1/20 0.31
RAB9A P51151 1/20 0.31
CCR5 P51681 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
SCHEMBL15329974 0.77 LMNA (0.31)
SCHEMBL21352397 0.75 JAK2 (0.36)
SCHEMBL114582 0.74 RAB9A (0.37) CCR1RAB9ACCR5
SCHEMBL29652865 0.74 RAB9A (0.37) CCR1RAB9ACCR5
SCHEMBL2554716 0.74
SCHEMBL29957634 0.72 CCR1 (0.52) CCR1RAB9ACCR5
SCHEMBL12260616 0.72 CCR1 (0.52) CCR1RAB9ACCR5
SCHEMBL29954944 0.70 NPC1 (0.33) RAB9A
SCHEMBL2555332 0.69 MGLL (0.43) RAB9A
SCHEMBL29954550 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed