SCHEMBL8006940

SCHEMBL8006940

Cc1ccccc1S(=O)(=O)NCC(=O)N1CC2(C)[C@H]1CN2C(=O)C(NC(=O)c1cc2ccccc2s1)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.37
STAT6 P42226 6/20 0.37
STAT5A P42229 3/20 0.37
STAT5B P51692 2/20 0.37
TRPV4 Q9HBA0 1/20 0.35
CTSK P43235 1/20 0.35
NPY5R Q15761 2/20 0.35
OPRM1 P35372 1/20 0.34
TAS1R3 Q7RTX0 2/20 0.34
TAS1R1 Q7RTX1 2/20 0.34
CCR8 P51685 1/20 0.34
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
POLB P06746 1/20 0.33
BLM P54132 1/20 0.33
KMT2A Q03164 1/20 0.33
PIN1 Q13526 1/20 0.33
CTSB P07858 1/20 0.33
CTSS P25774 1/20 0.33

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
SCHEMBL7995230 0.92 TRPV4 (0.41) CCR1STAT6STAT5ASTAT5BTRPV4
SCHEMBL7995042 0.91 NPY5R (0.42) CCR1STAT6STAT5ASTAT5BTRPV4
SCHEMBL7995564 0.90 TRPV4 (0.42) CCR1STAT6STAT5ASTAT5BTRPV4
SCHEMBL8007246 0.89 STAT6 (0.38) CCR1STAT6STAT5ASTAT5BTRPV4
SCHEMBL8007063 0.89 TRPV4 (0.42) CCR1STAT6STAT5ASTAT5BTRPV4
SCHEMBL8007066 0.89 TRPV4 (0.42) CCR1STAT6STAT5ASTAT5BTRPV4
SCHEMBL8007203 0.89 CCR1 (0.39) CCR1STAT6STAT5ASTAT5BTRPV4
SCHEMBL7995567 0.88 TRPV4 (0.42) CCR1STAT6STAT5ASTAT5BTRPV4
SCHEMBL8010889 0.88 STAT6 (0.36) CCR1STAT6STAT5ASTAT5BTRPV4
SCHEMBL8007251 0.87 TRPV4 (0.39) CCR1STAT6STAT5ASTAT5BTRPV4

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
WO-2009111680-A1 TRPV4 ANTAGONISTS SMITHLINE BEECHAM CORPORATION (US) 2009-09-11 WO disclosed