SCHEMBL16688191

SCHEMBL16688191

Cc1cc(Cl)cc(C2(C)CC(c3ccc(C(=O)N4CC(=O)N(CCC(F)(F)F)C(=O)C4)c(C)c3)=NO2)c1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 9/20 0.34
SLC5A2 P31639 1/20 0.31
KDM4E B2RXH2 2/20 0.31
ORAI1 Q96D31 2/20 0.30
MAPT P10636 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
SCHEMBL16688190 0.92 PTGDR2 (0.34) PTGDR2KDM4EMAPT
SCHEMBL16688153 0.92 PTGDR2 (0.36) PTGDR2KDM4EMAPT
SCHEMBL16688150 0.91 PTGDR2 (0.33) PTGDR2KDM4E
SCHEMBL18082514 0.91 PTGDR2 (0.34) PTGDR2KDM4EMAPT
SCHEMBL18082512 0.89 PTGDR2 (0.34) PTGDR2KDM4EMAPT
SCHEMBL16688158 0.88 PTGDR2 (0.35) PTGDR2KDM4EMAPT
SCHEMBL16688193 0.86 PTGDR2 (0.35) PTGDR2KDM4EMAPT
SCHEMBL16688228 0.86 PTGDR2 (0.32) PTGDR2KDM4EORAI1MAPT
SCHEMBL16688173 0.86 P2RX7 (0.34) PTGDR2KDM4EMAPT
SCHEMBL16688152 0.86 PTGDR2 (0.36) PTGDR2KDM4E

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-9447084-B2 Antiparisitic and pesticidal isoxazoline compounds MERIAL, INC. (US) 2016-09-20 US disclosed
US-20150126523-A1 ANTIPARISITIC AND PESTICIDAL ISOXAZOLINE COMPOUNDS MERIAL LIMITED (US) 2015-05-07 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-20150126523-A1 ANTIPARISITIC AND PESTICIDAL ISOXAZOLINE COMPOUNDS ACHE, PRDX1, CHRM1 PTGDR2 634/4885SLC5A2 1744/4885KDM4E 2875/4885

“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.