SCHEMBL875424

SCHEMBL875424

O=C(NC/C=N/OCc1ccccc1)c1ccc(C2=NOC(c3cc(Cl)c(F)c(Cl)c3)(C(F)(F)F)C2)c2ccccc12

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ORAI1 Q96D31 5/20 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
SCHEMBL875425 1.00 ORAI1 (0.34) ORAI1
SCHEMBL875426 1.00 ORAI1 (0.34) ORAI1
SCHEMBL875184 0.95 ORAI1 (0.34) ORAI1
SCHEMBL875183 0.95 ORAI1 (0.34) ORAI1
SCHEMBL875185 0.95 ORAI1 (0.34) ORAI1
SCHEMBL875328 0.95 ORAI1 (0.34) ORAI1
SCHEMBL875327 0.95 ORAI1 (0.34) ORAI1
SCHEMBL875329 0.95 ORAI1 (0.34) ORAI1
SCHEMBL10072337 0.92 ORAI1 (0.30) ORAI1
SCHEMBL871239 0.92 MEN1 (0.32)

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 2 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 disclosed
WO-2012038851-A1 ISOXAZOLINE OXIMES AS ANTIPARASITIC AGENTS PFIZER INC. (US) 2012-03-29 WO disclosed