SCHEMBL29692736

SCHEMBL29692736

CC1CC(c2cc(-n3c(=O)cc(C(F)(F)F)[nH]c3=O)ccc2Cl)=NO1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BCAT1 P54687 9/20 0.41
BCAT2 O15382 8/20 0.41
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HSD17B10 Q99714 2/20 0.35
PSEN1 P49768 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL32677867 0.83 BCAT1 (0.44) BCAT1BCAT2ALDH1A1SMN1; SMN2CYP2C9
SCHEMBL28425956 0.74 BCAT2 (0.36) BCAT1BCAT2
SCHEMBL28425958 0.73 BCAT1 (0.36) BCAT1BCAT2SMN1; SMN2TSHR
SCHEMBL21653845 0.73 BCAT1 (0.38) BCAT1BCAT2ALDH1A1SMN1; SMN2HSD17B10
SCHEMBL2838083 0.73 BCAT1 (0.43) BCAT1BCAT2SMN1; SMN2
SCHEMBL1573292 0.73 BCAT1 (0.43) BCAT1BCAT2ALDH1A1SMN1; SMN2CYP2C9
SCHEMBL2840843 0.72 BCAT1 (0.42) BCAT1BCAT2ALDH1A1SMN1; SMN2CYP2C9
SCHEMBL2832383 0.72 BCAT1 (0.43) BCAT1BCAT2SMN1; SMN2
SCHEMBL9423250 0.70 BCAT1 (0.48) BCAT1BCAT2KMT2AALDH1A1SMN1; SMN2
SCHEMBL9274567 0.69 TDP1 (0.50) BCAT1BCAT2ALDH1A1SMN1; SMN2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12503462-B2 Method for preparing isoxazoline-containing uracil compound through methylation SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2025-12-23 US disclosed
EP-3858829-B1 METHOD FOR PREPARING ISOXAZOLINE-CONTAINING URACIL COMPOUND BY METHYLATION SHENYANG SINOCHEM AGROCHEMICALS R & D CO LTD (CN) 2024-05-01 EP disclosed
CN-110964001-B Method for preparing isoxazoline-containing uracil compound through methylation 沈阳中化农药化工研发有限公司 2022-07-22 CN 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-12503462-B2 Method for preparing isoxazoline-containing uracil compound through methylation UNG, DNMT1, NUDT1 BCAT1 659/4885BCAT2 684/4885KMT2A 234/4885

“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.