SCHEMBL515841

SCHEMBL515841

CC(=NO)c1ccc(S(C)(=O)=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.50
PTGS2 P35354 2/20 0.50
FAAH O00519 6/20 0.48
MGLL Q99685 5/20 0.48
EGFR P00533 1/20 0.45
BRAF P15056 1/20 0.45
CA9 Q16790 2/20 0.45
GSR P00390 1/20 0.43

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
SCHEMBL515840 1.00 ENPP2 (0.50) ENPP2PTGS2FAAHMGLLEGFR
Methylphenylsulfone SCHEMBL28253216 0.86 PTGS2 (0.54) PTGS2FAAHMGLLEGFRBRAF
SCHEMBL7467876 0.82 CA2 (0.54) CA9
SCHEMBL7467884 0.82 CA2 (0.54) CA9
SCHEMBL12360950 0.79 CA9 (0.52) CA9
SCHEMBL14298196 0.79 CA9 (0.52) CA9
SCHEMBL8304940 0.79 HTR6 (0.52) PTGS2CA9
SCHEMBL4033649 0.78 GRIN2B (0.57) ENPP2PTGS2GSR
SCHEMBL9136413 0.78 ENPP2 (0.48) ENPP2PTGS2GSR
SCHEMBL8289058 0.78 GRIN2B (0.57) ENPP2PTGS2GSR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110642748-B O- (2-trifluoromethyl-2-hydroxyethyl) oxime ether derivative and synthetic method and application thereof 华南理工大学 2023-03-31 CN disclosed
CN-110642748-A O- (2-trifluoromethyl-2-hydroxyethyl) oxime ether derivative and synthetic method and application thereof 华南理工大学 2020-01-03 CN disclosed
US-8742117-B2 Oxime derivatives CADILA HEALTHCARE LIMITED (IN) 2014-06-03 US disclosed
EP-2379542-B1 NOVEL OXIME DERIVATIVES CADILA HEALTHCARE LTD (IN) 2013-02-13 EP disclosed
US-20120028996-A1 NOVEL OXIME DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2012-02-02 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-20120028996-A1 NOVEL OXIME DERIVATIVES CYP11B2, CYP11B1, PYGL ENPP2 1353/4885PTGS2 216/4885FAAH 4224/4885

“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.