Sugi Predict

Sugi Predict / Compounds / SCHEMBL8007205

SCHEMBL8007205

SCHEMBL8007205

CC(C)[C@H](NS(=O)(=O)c1ccc(Cl)cc1Cl)C(=O)N1CC2(C)[C@H]1CN2C(=O)C(NC(=O)c1cc2ccccc2s1)C(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TRPV4 Q9HBA0 2/20 0.52
▸ CCR1 P32246 2/20 0.45
▸ STAT6 P42226 7/20 0.35
▸ UTS2R Q9UKP6 1/20 0.35
▸ STAT5A P42229 3/20 0.34
▸ STAT5B P51692 2/20 0.34
▸ NPY5R Q15761 1/20 0.34
▸ PIN1 Q13526 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ TAS1R3 Q7RTX0 2/20 0.33
▸ TAS1R1 Q7RTX1 2/20 0.33
▸ TAAR1 Q96RJ0 1/20 0.33
▸ CTSK P43235 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
SCHEMBL8010544 0.94 TRPV4 (0.52) TRPV4CCR1STAT6UTS2RSTAT5A
SCHEMBL8008215 0.90 TRPV4 (0.65) TRPV4CCR1UTS2RNPY5RPIN1
SCHEMBL4061326 0.87 TRPV4 (0.55) TRPV4CCR1STAT6UTS2RSTAT5A
SCHEMBL8006169 0.84 TRPV4 (0.50) TRPV4CCR1UTS2RNPY5RPIN1
SCHEMBL8008220 0.84 TRPV4 (0.66) TRPV4CCR1UTS2RNPY5RPIN1
SCHEMBL8007063 0.83 TRPV4 (0.42) TRPV4CCR1STAT6STAT5ASTAT5B
SCHEMBL8007066 0.83 TRPV4 (0.42) TRPV4CCR1STAT6STAT5ASTAT5B
SCHEMBL8006952 0.82 TRPV4 (0.74) TRPV4CCR1UTS2RNPY5RPIN1
SCHEMBL8004713 0.82 TRPV4 (0.74) TRPV4CCR1UTS2RNPY5RPIN1
SCHEMBL7995564 0.82 TRPV4 (0.42) TRPV4CCR1STAT6STAT5ASTAT5B

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