SCHEMBL19856913

SCHEMBL19856913

CC(C)(C)C(NC(=O)c1cc2ccccc2s1)C(=O)N1C[C@@H]2C[C@H]1CN2C(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT6 P42226 9/20 0.45
TRPV4 Q9HBA0 2/20 0.45
STAT5A P42229 6/20 0.44
STAT5B P51692 5/20 0.44
CCR1 P32246 1/20 0.43
CASP1 P29466 2/20 0.36
CASP4 P49662 1/20 0.36
CASP5 P51878 1/20 0.36
CASP7 P55210 1/20 0.36
CASP9 P55211 1/20 0.36
CASP8 Q14790 1/20 0.36
CASP10 Q92851 1/20 0.36
CHRNA7 P36544 2/20 0.36
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
HTR3A P46098 1/20 0.36
HTR3D Q70Z44 1/20 0.36
HTR3C Q8WXA8 1/20 0.36
POLB P06746 2/20 0.36
HCRTR1 O43613 1/20 0.36

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
SCHEMBL4061326 0.84 TRPV4 (0.55) STAT6TRPV4STAT5ASTAT5BCCR1
SCHEMBL4350448 0.83 STAT6 (0.40) STAT6POLBALOX15
SCHEMBL4060306 0.83 TRPV4 (0.55) STAT6TRPV4STAT5ASTAT5BCCR1
SCHEMBL4053522 0.82 TRPV4 (0.51) STAT6TRPV4STAT5ASTAT5BCCR1
SCHEMBL4340949 0.81 STAT6 (0.39) STAT6CCR1ALOX15
SCHEMBL4053125 0.81 TRPV4 (0.65) STAT6TRPV4STAT5ASTAT5BCCR1
SCHEMBL4050277 0.80 TRPV4 (0.56) STAT6TRPV4STAT5ASTAT5BCCR1
SCHEMBL4050161 0.80 TRPV4 (0.56) STAT6TRPV4STAT5ASTAT5BCCR1
SCHEMBL4049701 0.80 TRPV4 (0.65) STAT6TRPV4STAT5ASTAT5BCCR1
SCHEMBL4338819 0.78 STAT6 (0.40) STAT6POLBALOX15

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
EP-2925857-B1 USE OF TRPV4 ANTAGONISTS TO AMELIORATE HYDROCEPHALUS AND RELATED MATERIALS AND METHODS UNIV INDIANA RES & TECH CORP (US) 2018-02-14 EP claimed