SCHEMBL28076112

SCHEMBL28076112

O=[SH](=O)Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(F)cc1F

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 16/20 0.64
SLC40A1 Q9NP59 2/20 0.46
ACLY P53396 1/20 0.44
PIK3CD O00329 1/20 0.44

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
SCHEMBL28808565 0.94 CCR2 (0.61) CCR2SLC40A1
SCHEMBL27943751 0.80 CCR2 (0.63) CCR2SLC40A1ACLY
SCHEMBL9933360 0.78 CCR2 (1.00) CCR2
SCHEMBL21442611 0.75 CCR2 (0.63) CCR2ACLYPIK3CD
SCHEMBL9934423 0.75 CCR2 (0.88) CCR2
SCHEMBL3748809 0.75 CCR2 (0.67) CCR2ACLY
SCHEMBL9934374 0.74 CCR2 (0.69) CCR2SLC40A1ACLYPIK3CD
SCHEMBL27943738 0.73 CCR2 (0.59) CCR2
SCHEMBL7572525 0.73 CCR2 (0.63) CCR2
SCHEMBL3743872 0.72 CCR2 (0.66) CCR2ACLY

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103380115-B Sulfur derivatives as chemokine receptor modulators 阿勒根公司 2016-08-24 CN claimed
CN-106220618-B Sulfur derivatives as chemokine receptor modulators 阿勒根公司 2019-04-26 CN disclosed
CN-106220618-A SULFUR DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS 阿勒根公司 2016-12-14 CN disclosed
CN-103380115-B Sulfur derivatives as chemokine receptor modulators 阿勒根公司 2016-08-24 CN disclosed