SCHEMBL978728

SCHEMBL978728

CS(=O)(=O)CC(=O)NCc1ccc(C2=NOC(c3cc(Br)cc(C(F)(F)F)c3)(C(F)(F)F)C2)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.36
NR1H4 Q96RI1 4/20 0.36
DDR1 Q08345 3/20 0.36
TRPV1 Q8NER1 3/20 0.35
MGAT2 Q10469 5/20 0.35
LMNA P02545 1/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
P2RX7 Q99572 2/20 0.32

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
SCHEMBL16243409 0.89 PTGES (0.35) EPHX2NR1H4DDR1LMNACA1
SCHEMBL15492050 0.89 PTGES (0.35) EPHX2NR1H4DDR1LMNACA1
SCHEMBL981696 0.87 EPHX2 (0.35) EPHX2NR1H4DDR1TRPV1LMNA
SCHEMBL979609 0.83 TRPV1 (0.34) EPHX2NR1H4DDR1TRPV1LMNA
SCHEMBL3625711 0.82 GPBAR1 (0.32)
SCHEMBL980954 0.81 TRPV1 (0.35) EPHX2NR1H4TRPV1LMNACA1
SCHEMBL980463 0.80
SCHEMBL979491 0.80 HSD11B1 (0.35) EPHX2NR1H4LMNACA1CA2
SCHEMBL981224 0.80 TRPV1 (0.36) EPHX2NR1H4TRPV1LMNACA1
SCHEMBL1857748 0.79 LMNA (0.41) EPHX2LMNAP2RX7

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-8318757-B2 Substituted isoxazoline compound and pest control agent NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-11-27 US disclosed
US-20110009438-A1 SUBSTITUTED ISOXAZOLINE COMPOUND AND PEST CONTROL AGENT NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-01-13 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-20110009438-A1 SUBSTITUTED ISOXAZOLINE COMPOUND AND PEST CONTROL AGENT CCR10, H1-10, CCL11 EPHX2 2604/4885NR1H4 1645/4885DDR1 2835/4885

“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.