SCHEMBL10072338

SCHEMBL10072338

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

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 6/20 0.34
HPGD P15428 3/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
MAPT P10636 4/20 0.32
LMNA P02545 2/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPK1 P28482 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
PLIN1 O60240 1/20 0.32
GLA P06280 1/20 0.32
POLB P06746 1/20 0.32
PKM P14618 1/20 0.32
PLIN5 Q00G26 1/20 0.32
MCL1 Q07820 1/20 0.32
ABHD5 Q8WTS1 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
SLC6A4 P31645 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
SCHEMBL10072339 0.91 HPGD (0.35) PDK2HPGDCA1CA2LMNA
SCHEMBL869871 0.90 PDK2 (0.40) PDK2CA1CA2MAPTLMNA
SCHEMBL10072323 0.90 CFTR (0.34) PDK2HPGDCA1CA2MAPT
SCHEMBL16692835 0.90 PDK2 (0.40) PDK2HPGDMAPTLMNAKDM4E
SCHEMBL870666 0.90 CFTR (0.34) PDK2CA1CA2MAPTLMNA
SCHEMBL10072328 0.86 PDK2 (0.35) PDK2HPGDCA1CA2MAPT
SCHEMBL871262 0.86 PDK2 (0.40) PDK2CA1CA2MAPTLMNA
SCHEMBL869547 0.86 PDK2 (0.42) PDK2HPGDCA1CA2MAPT
SCHEMBL869874 0.86 CFTR (0.37) PDK2CA1CA2MAPTLMNA
SCHEMBL10072346 0.85 CA1 (0.35) PDK2HPGDCA1CA2MAPT

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 618/4885HPGD 1699/4885CA1 2008/4885

“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.