SCHEMBL8007246

SCHEMBL8007246

CC(C)(C)C(NC(=O)c1cc2ccccc2s1)C(=O)N1C[C@H]2N(C(=O)CNS(=O)(=O)c3ccc4ccccc4c3)CC21C

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
STAT6 P42226 6/20 0.38
STAT5A P42229 3/20 0.38
STAT5B P51692 2/20 0.38
NPY5R Q15761 4/20 0.37
F2 P00734 3/20 0.37
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
POLB P06746 1/20 0.36
BLM P54132 1/20 0.36
KMT2A Q03164 1/20 0.36
TRPV4 Q9HBA0 1/20 0.35
CCR1 P32246 1/20 0.35
CTSK P43235 1/20 0.35
CTSS P25774 1/20 0.35
ACACB O00763 1/20 0.34

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
SCHEMBL7995042 0.94 NPY5R (0.42) STAT6STAT5ASTAT5BNPY5RMEN1
SCHEMBL8007251 0.91 TRPV4 (0.39) STAT6STAT5ASTAT5BNPY5RMEN1
SCHEMBL8007254 0.90 NPY5R (0.37) STAT6STAT5ASTAT5BNPY5RMEN1
SCHEMBL8010889 0.90 STAT6 (0.36) STAT6STAT5ASTAT5BNPY5RMEN1
SCHEMBL8006940 0.89 CCR1 (0.37) STAT6STAT5ASTAT5BNPY5RMEN1
SCHEMBL8007248 0.89 NPY5R (0.35) STAT6STAT5ASTAT5BNPY5RTRPV4
SCHEMBL7995230 0.89 TRPV4 (0.41) STAT6STAT5ASTAT5BNPY5RTRPV4
SCHEMBL8007203 0.88 CCR1 (0.39) STAT6STAT5ASTAT5BNPY5RTRPV4
SCHEMBL8007066 0.87 TRPV4 (0.42) STAT6STAT5ASTAT5BNPY5RTRPV4
SCHEMBL8007063 0.87 TRPV4 (0.42) STAT6STAT5ASTAT5BNPY5RTRPV4

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