SCHEMBL876047

SCHEMBL876047

CON=CCNC(=O)c1ccc(C2=NOC(c3cc(Cl)c(Cl)c(Cl)c3)(C(F)(F)F)C2)c2ccccc12

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.33
ORAI1 Q96D31 1/20 0.31

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
SCHEMBL876046 1.00 PDK2 (0.33) PDK2ORAI1
SCHEMBL876045 1.00 PDK2 (0.33) PDK2ORAI1
SCHEMBL883516 0.95 POLB (0.31) PDK2
SCHEMBL12503961 0.95 POLB (0.31) PDK2
SCHEMBL12503962 0.95 POLB (0.31) PDK2
SCHEMBL10072316 0.95 PDK2 (0.31) PDK2ORAI1
SCHEMBL883513 0.93 PDK2 (0.31) PDK2ORAI1
SCHEMBL10072319 0.93 PDK2 (0.32) PDK2ORAI1
SCHEMBL12503972 0.92 ACACB (0.32) PDK2ORAI1
SCHEMBL12503970 0.92 ACACB (0.32) PDK2ORAI1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2619189-A1 ISOXAZOLINE OXIMES AS ANTIPARASITIC AGENTS Zoetis LLC (US) 2013-07-31 EP claimed
WO-2012038851-A1 ISOXAZOLINE OXIMES AS ANTIPARASITIC AGENTS PFIZER INC. (US) 2012-03-29 WO claimed
EP-2619189-A1 ISOXAZOLINE OXIMES AS ANTIPARASITIC AGENTS Zoetis LLC (US) 2013-07-31 EP disclosed
WO-2012038851-A1 ISOXAZOLINE OXIMES AS ANTIPARASITIC AGENTS PFIZER INC. (US) 2012-03-29 WO disclosed