SCHEMBL8538263

SCHEMBL8538263

Cc1cc(S(=O)(=O)C2CC2)c(C(F)(F)F)cc1C(=O)Cl

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 1/20 0.35
SLC9A1 P19634 2/20 0.34
KCNH2 Q12809 1/20 0.34
EPHX2 P34913 2/20 0.33
CNR2 P34972 4/20 0.32
HCRTR1 O43613 1/20 0.31
CTSS P25774 2/20 0.31
KMT2A Q03164 2/20 0.30
DDR1 Q08345 2/20 0.30
ELOVL6 Q9H5J4 1/20 0.30
CCR8 P51685 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
SCHEMBL8540494 0.95 CA12 (0.35) CCR2SLC9A1KCNH2EPHX2CNR2
SCHEMBL8537147 0.95 CA12 (0.33) CCR2SLC9A1KCNH2EPHX2CNR2
SCHEMBL8544558 0.94 CA12 (0.37) EPHX2CNR2DDR1
SCHEMBL8543067 0.94 CA12 (0.37) EPHX2CNR2DDR1
SCHEMBL8538912 0.84 CCR2 (0.34) CCR2EPHX2CNR2CTSSDDR1
SCHEMBL8541311 0.83 TAS1R3 (0.34) SLC9A1KCNH2EPHX2CNR2HCRTR1
SCHEMBL8541951 0.81 SLC9A1 (0.41) SLC9A1
SCHEMBL6937870 0.81 SLC9A1 (0.54) SLC9A1KCNH2
SCHEMBL8536966 0.80 CNR2 (0.32) SLC9A1CNR2KMT2A
SCHEMBL8543281 0.80 CA12 (0.37) DDR1

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-5744641-A Sulfonyl- or sulfinylbenzoylguanidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-04-28 US disclosed