SCHEMBL25166724

SCHEMBL25166724

CC1(CCC(=O)O)CC(c2cc(N)c(F)cc2Cl)=NO1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 3/20 0.35
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ ITGB1 P05556 1/20 0.32
▸ ITGA4 P13612 1/20 0.32
▸ PTGDR2 Q9Y5Y4 2/20 0.31
▸ SSTR5 P35346 1/20 0.31
▸ AKR1B1 P15121 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ F10 P00742 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
SCHEMBL28363145 0.88 SSTR5 (0.33) CA1CA2SSTR5KDM4EF10
SCHEMBL21635544 0.84 CA1 (0.32) CA1CA2KDM4EF10
SCHEMBL25166774 0.83 AKR1B1 (0.36) FFAR4CA1CA2ITGB1ITGA4
SCHEMBL22714398 0.82 CA1 (0.33) CA1CA2ITGB1ITGA4SSTR5
SCHEMBL28549471 0.81 CA1 (0.44) FFAR4CA1CA2ITGB1ITGA4
SCHEMBL30122895 0.81 CA1 (0.44) FFAR4CA1CA2ITGB1ITGA4
SCHEMBL21635545 0.81 CA1 (0.44) FFAR4CA1CA2ITGB1ITGA4
SCHEMBL28570370 0.81 CA1 (0.44) FFAR4CA1CA2ITGB1ITGA4
SCHEMBL30122767 0.81 CA1 (0.44) FFAR4CA1CA2ITGB1ITGA4
SCHEMBL22714376 0.78 CA1 (0.44) CA1CA2ITGB1ITGA4SSTR5

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-20230303545-A1 PREPARATION METHOD OF PHENYLISOXAZOLINE COMPOUND SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2023-09-28 — — US disclosed
EP-4177250-A1 PREPARATION METHOD FOR PHENYLISOXAZOLINE COMPOUND Shenyang Sinochem Agrochemicals R & D Co., Ltd. (CN) 2023-05-10 — — EP 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-20230303545-A1 PREPARATION METHOD OF PHENYLISOXAZOLINE COMPOUND UMPS, UGT1A7, UGT2B7 FFAR4 1470/4885CA1 4252/4885CA2 4650/4885

“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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