SCHEMBL1547516

SCHEMBL1547516

CCOC(=O)Nc1cc(C2=NOC(c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2)ccc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.37
ALDH1A1 P00352 3/20 0.36
LMNA P02545 3/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
BPTF Q12830 2/20 0.35
TRIM24 O15164 1/20 0.35
BRD4 O60885 1/20 0.35
BRD1 O95696 1/20 0.35
TAF1 P21675 1/20 0.35
BRD2 P25440 1/20 0.35
SMARCA4 P51532 1/20 0.35
BRPF1 P55201 1/20 0.35
BRDT Q58F21 1/20 0.35
ATAD2 Q6PL18 1/20 0.35
PBRM1 Q86U86 1/20 0.35
TAF1L Q8IZX4 1/20 0.35

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
SCHEMBL1547926 0.95 LMNA (0.39) NLRP3ALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL1548011 0.93 SMN1; SMN2 (0.41) NLRP3ALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL1547801 0.93 LMNA (0.35) NLRP3ALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL1547920 0.92 LMNA (0.34) ALDH1A1LMNAMAPK1SMN1; SMN2TP53
SCHEMBL1547376 0.92 LMNA (0.38) NLRP3ALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL1548043 0.92 CA1 (0.35) ALDH1A1LMNAMAPK1SMN1; SMN2TP53
SCHEMBL1547509 0.91 MEN1 (0.41) NLRP3ALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL13299425 0.91 LMNA (0.34) NLRP3ALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL1547959 0.91 HDAC1 (0.37) ALDH1A1LMNAMAPK1SMN1; SMN2HDAC3
SCHEMBL3670712 0.91 MEN1 (0.40) NLRP3ALDH1A1LMNAMAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2311817-A1 Isoxazoline Compounds and their Use in Pest Control Sumitomo Chemical Company, Limited (JP) 2011-04-20 EP disclosed
US-20100137372-A1 ISOXAZOLINE COMPOUNDS AND THEIR USE IN PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-03 US disclosed
US-20100137372-A1 ISOXAZOLINE COMPOUNDS AND THEIR USE IN PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-03 US disclosed
US-20100137372-A1 ISOXAZOLINE COMPOUNDS AND THEIR USE IN PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-03 US disclosed
EP-2139874-A2 ISOXAZOLINE COMPOUNDS AND THEIR USE IN PEST CONTROL Sumitomo Chemical Company, Limited (JP) 2010-01-06 EP disclosed
WO-2008126665-A2 ISOXAZOLINE COMPOUNDS AND THEIR USE IN PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-10-23 WO 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-20100137372-A1 ISOXAZOLINE COMPOUNDS AND THEIR USE IN PEST CONTROL CYP4X1, PRDX5, PRDX1 NLRP3 2121/4885ALDH1A1 1299/4885LMNA 1952/4885

“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.