SCHEMBL875183

SCHEMBL875183

O=C(NC/C=N/OCc1cccc(Cl)c1)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 12)

geneUniProtsupporting neighboursconfidence
ORAI1 Q96D31 5/20 0.34
TP53 P04637 2/20 0.33
POLB P06746 1/20 0.32
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
CNR2 P34972 2/20 0.31
CCR1 P32246 1/20 0.31
MEN1 O00255 1/20 0.31
HCRTR1 O43613 1/20 0.31
KMT2A Q03164 1/20 0.31
EPHX2 P34913 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
SCHEMBL875184 1.00 ORAI1 (0.34) ORAI1TP53POLBLMNAHPGD
SCHEMBL875185 1.00 ORAI1 (0.34) ORAI1TP53POLBLMNAHPGD
SCHEMBL875426 0.95 ORAI1 (0.34) ORAI1
SCHEMBL875425 0.95 ORAI1 (0.34) ORAI1
SCHEMBL875424 0.95 ORAI1 (0.34) ORAI1
SCHEMBL875327 0.90 ORAI1 (0.34) ORAI1
SCHEMBL875328 0.90 ORAI1 (0.34) ORAI1
SCHEMBL875329 0.90 ORAI1 (0.34) ORAI1
SCHEMBL10072337 0.90 ORAI1 (0.30) ORAI1
SCHEMBL871239 0.90 MEN1 (0.32) MEN1KMT2A

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