SCHEMBL871259

SCHEMBL871259

CO/N=C(\CNC(=O)c1ccc(C2=NOC(c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2)c2ccccc12)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.34
CYP2D6 P10635 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
PDK2 Q15119 1/20 0.32
FAP Q12884 4/20 0.32
MAPT P10636 1/20 0.32
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
KMT2A Q03164 1/20 0.30
PREP P48147 2/20 0.30
POLB P06746 1/20 0.30
PITRM1 Q5JRX3 1/20 0.30
DPP8 Q6V1X1 1/20 0.30
DPP9 Q86TI2 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
SCHEMBL871261 1.00 CYP1A2 (0.34) CYP1A2CYP2D6CYP2C9CYP2C19PDK2
SCHEMBL871260 1.00 CYP1A2 (0.34) CYP1A2CYP2D6CYP2C9CYP2C19PDK2
SCHEMBL871406 0.93 FAP (0.30) FAPPREPPITRM1DPP8DPP9
SCHEMBL871408 0.93 FAP (0.30) FAPPREPPITRM1DPP8DPP9
SCHEMBL871407 0.93 FAP (0.30) FAPPREPPITRM1DPP8DPP9
SCHEMBL870538 0.92 CYP1A2 (0.33) CYP1A2CYP2D6CYP2C9CYP2C19FAP
SCHEMBL870536 0.92 CYP1A2 (0.33) CYP1A2CYP2D6CYP2C9CYP2C19FAP
SCHEMBL870537 0.92 CYP1A2 (0.33) CYP1A2CYP2D6CYP2C9CYP2C19FAP
SCHEMBL870775 0.91 PREP (0.31) FAPPREPPITRM1DPP8DPP9
SCHEMBL870776 0.91 PREP (0.31) FAPPREPPITRM1DPP8DPP9

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 CYP1A2 1/4885CYP2D6 35/4885CYP2C9 10/4885

“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.