SCHEMBL25515573

SCHEMBL25515573

O=COCc1c(-c2ccccc2OC(F)(F)F)noc1C1CC1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 20/20 0.62
▸ HSD17B13 Q7Z5P4 1/20 0.62

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
SCHEMBL22789989 0.87 NR1H4 (0.59) NR1H4HSD17B13
SCHEMBL28375306 0.86 NR1H4 (0.64) NR1H4HSD17B13
SCHEMBL20833613 0.86 NR1H4 (0.63) NR1H4HSD17B13
SCHEMBL26923025 0.85 NR1H4 (0.62) NR1H4HSD17B13
SCHEMBL22078599 0.84 NR1H4 (0.61) NR1H4HSD17B13
SCHEMBL21912532 0.84 NR1H4 (0.61) NR1H4HSD17B13
SCHEMBL20632491 0.83 NR1H4 (0.60) NR1H4HSD17B13
SCHEMBL1096074 0.83 NR1H4 (0.60) NR1H4HSD17B13
SCHEMBL22654652 0.83 NR1H4 (0.60) NR1H4HSD17B13
SCHEMBL22654654 0.83 NR1H4 (0.60) NR1H4HSD17B13

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-11667629-B2 Isoxazole derivative, preparation method therefor, and use thereof SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2023-06-06 — — US disclosed
CN-110128432-A Tricyclic nitrogen containing compounds and its application in drug 广东东阳光药业有限公司 2019-08-16 — — 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-11667629-B2 Isoxazole derivative, preparation method therefor, and use thereof CYP4A11, CYP4F11, SLC10A1 NR1H4 6/4885HSD17B13 70/4885

“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.

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