SCHEMBL10072317

SCHEMBL10072317

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

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.32
ACACA Q13085 1/20 0.32
S1PR3 Q99500 1/20 0.30
ORAI1 Q96D31 1/20 0.30

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
SCHEMBL12503963 1.00 ACACB (0.32) ACACBACACAS1PR3ORAI1
SCHEMBL12503964 1.00 ACACB (0.32) ACACBACACAS1PR3ORAI1
SCHEMBL12503973 0.95 ACACB (0.32) ACACBACACAORAI1
SCHEMBL12503972 0.95 ACACB (0.32) ACACBACACAORAI1
SCHEMBL12503970 0.95 ACACB (0.32) ACACBACACAORAI1
SCHEMBL875256 0.93 ACACB (0.32) ACACBACACAS1PR3ORAI1
SCHEMBL10072316 0.93 PDK2 (0.31) ORAI1
SCHEMBL875258 0.93 ACACB (0.32) ACACBACACAS1PR3ORAI1
SCHEMBL875257 0.93 ACACB (0.32) ACACBACACAS1PR3ORAI1
SCHEMBL10072337 0.92 ORAI1 (0.30) ORAI1

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 disclosed
US-8404649-B2 Isoxazoline oximes as antiparasitic agents AH USA 42 LLC (US) 2013-03-26 US disclosed
WO-2012038851-A1 ISOXAZOLINE OXIMES AS ANTIPARASITIC AGENTS PFIZER INC. (US) 2012-03-29 WO disclosed
US-20120077765-A1 ISOXAZOLINE OXIMES AS ANTIPARASITIC AGENTS PFIZER INC. (US) 2012-03-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120077765-A1 ISOXAZOLINE OXIMES AS ANTIPARASITIC AGENTS CYP1A2, CYP3A7, CYP2E1 ACACB 3127/4885ACACA 3425/4885S1PR3 2046/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.