SCHEMBL23701552

SCHEMBL23701552

NC(=O)NSNC(=O)c1ccccc1Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 4/20 0.51
▸ PTGS1 P23219 2/20 0.47
▸ SIRT2 Q8IXJ6 4/20 0.46
▸ MAPK8 P45983 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ ABCG2 Q9UNQ0 1/20 0.43
▸ TAS2R14 Q9NYV8 3/20 0.43
▸ POLB P06746 1/20 0.43
▸ AKR1C3 P42330 1/20 0.43
▸ AKR1C2 P52895 1/20 0.43
▸ KIF11 P52732 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43

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
SCHEMBL20553269 0.81 RXFP1 (0.58) RXFP1PTGS1SIRT2MAPK8SMN1; SMN2
SCHEMBL22571369 0.81 SIRT2 (0.62) RXFP1PTGS1SIRT2MAPK8TAS2R14
SCHEMBL22556306 0.80 RXFP1 (0.53) RXFP1PTGS1SIRT2MAPK8SMN1; SMN2
SCHEMBL22635632 0.78 TEAD1 (0.48) AKR1C3AKR1C2
SCHEMBL4245559 0.77 MAPK8 (0.67) RXFP1PTGS1MAPK8TAS2R14AKR1C3
SCHEMBL25279533 0.76 AKR1C3 (0.60) RXFP1PTGS1SIRT2MAPK8SMN1; SMN2
SCHEMBL21764748 0.76 RXFP1 (0.47) RXFP1PTGS1SIRT2MAPK8SMN1; SMN2
SCHEMBL22556324 0.75 RXFP1 (0.48) RXFP1PTGS1SIRT2MAPK8SMN1; SMN2
SCHEMBL21765032 0.73 MAPT (0.69) RXFP1SIRT2MAPK8TAS2R14POLB
SCHEMBL23701538 0.72 RXFP1 (0.51) RXFP1PTGS1MAPK8SMN1; SMN2ABCG2

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-11661403-B2 Oxadiazole compounds VIVACE THERAPEUTICS, INC. (US) 2023-05-30 — — US disclosed
US-20210238154-A1 OXADIAZOLE COMPOUNDS VIVACE THERAPEUTICS, INC. 2021-08-05 — — 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 (2 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-20210238154-A1 OXADIAZOLE COMPOUNDS YAP1, TEAD2, TEAD3 RXFP1 3511/4885PTGS1 2113/4885SIRT2 1044/4885
US-11661403-B2 Oxadiazole compounds YAP1, TEAD2, TEAD3 RXFP1 3511/4885PTGS1 2113/4885SIRT2 1044/4885

“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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