SCHEMBL23344168

SCHEMBL23344168

Cc1cc(C2=NO[C@@](c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2)ccc1C(=O)NCC(=O)NC(C)C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR139 Q6DWJ6 5/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
PSMB5 P28074 5/20 0.32
PSMB1 P20618 3/20 0.32
PSMB2 P49721 3/20 0.32
PSMB11 A5LHX3 2/20 0.32
PSMA7 O14818 2/20 0.32
PSMA1 P25786 2/20 0.32
PSMA2 P25787 2/20 0.32
PSMA3 P25788 2/20 0.32
PSMA4 P25789 2/20 0.32
PSMB8 P28062 2/20 0.32
PSMB9 P28065 2/20 0.32
PSMA5 P28066 2/20 0.32
PSMB4 P28070 2/20 0.32
PSMB6 P28072 2/20 0.32
PSMB10 P40306 2/20 0.32
PSMB3 P49720 2/20 0.32
PSMA6 P60900 2/20 0.32

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
SCHEMBL12846263 1.00 GPR139 (0.34) GPR139CA1CA2PSMB5PSMB1
SCHEMBL28921949 0.92 CA1 (0.32) GPR139CA1CA2PSMB5HDAC4
SCHEMBL12846265 0.92 HDAC4 (0.38) CA1CA2HDAC4CCR2
SCHEMBL12846262 0.90 TTK (0.33) CA1CA2HDAC4
Fluralaner SCHEMBL8515337 0.89 CA1 (0.32) CA1CA2HDAC4
Fluralaner SCHEMBL8513367 0.89 CA1 (0.32) CA1CA2HDAC4
Fluralaner SCHEMBL29399660 0.89 CA1 (0.32) CA1CA2HDAC4
Fluralaner SCHEMBL121934 0.89 CA1 (0.32) CA1CA2HDAC4
Fluralaner SCHEMBL29362559 0.89 CA1 (0.32) CA1CA2HDAC4
SCHEMBL737408 0.89 EGLN1 (0.36) CA1CA2

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-3473101-B1 ISOXAZOLINE COMPOSITIONS AND THEIR USE AS ANTIPARASITICS FOR FELINES INTERVET INT BV (NL) 2021-05-12 EP disclosed