SCHEMBL10072328

SCHEMBL10072328

COC(=O)c1ccc(C2=NOC(c3cc(C)c(F)c(F)c3)(C(F)(F)F)C2)c2ccccc12

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 10/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
MAPT P10636 2/20 0.32
HPGD P15428 1/20 0.31
F2 P00734 1/20 0.31
F10 P00742 1/20 0.31
PRSS1 P07477 1/20 0.31
NPC1 O15118 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
LMNA P02545 1/20 0.30
TSHR P16473 1/20 0.30
HTT P42858 1/20 0.30
MAPK10 P53779 1/20 0.30
CNR1 P21554 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
SCHEMBL10072329 0.91 CA1 (0.34) PDK2CA1CA2HPGD
SCHEMBL870673 0.90 CA1 (0.34) PDK2CA1CA2MAPTF2
SCHEMBL10072346 0.90 CA1 (0.35) PDK2CA1CA2MAPTHPGD
SCHEMBL871262 0.87 PDK2 (0.40) PDK2CA1CA2MAPTF2
SCHEMBL10072338 0.86 PDK2 (0.34) PDK2CA1CA2MAPTHPGD
SCHEMBL10072330 0.85 ALOX5AP (0.35) PDK2CA1CA2LMNAHTT
SCHEMBL869547 0.85 PDK2 (0.42) PDK2CA1CA2MAPTHPGD
SCHEMBL869874 0.85 CFTR (0.37) PDK2CA1CA2MAPTF2
SCHEMBL10072331 0.85 CA1 (0.32) CA1CA2HTT
SCHEMBL870037 0.84 PDK2 (0.43) PDK2CA1CA2MAPTF2

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
US-8404649-B2 Isoxazoline oximes as antiparasitic agents AH USA 42 LLC (US) 2013-03-26 US 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 PDK2 618/4885CA1 2008/4885CA2 1391/4885

“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.