SCHEMBL22556489

SCHEMBL22556489

O=C1N[C@@H](c2nnc(-c3ccccc3Nc3ccc(C(F)(F)F)cc3)o2)CO1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 2/20 0.39
▸ KDR P35968 5/20 0.38
▸ FLT1 P17948 3/20 0.38
▸ ABCG2 Q9UNQ0 1/20 0.37
▸ TAS2R14 Q9NYV8 1/20 0.37
▸ AKR1C3 P42330 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ TP53 P04637 2/20 0.34
▸ MGAM O43451 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ SI P14410 1/20 0.33
▸ MGAM2 Q2M2H8 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ C1R P00736 1/20 0.32
▸ TEAD1 P28347 1/20 0.32

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
SCHEMBL30463754 1.00 GSK3B (0.39) GSK3BKDRFLT1ABCG2TAS2R14
SCHEMBL22556407 1.00 GSK3B (0.39) GSK3BKDRFLT1ABCG2TAS2R14
SCHEMBL22556409 1.00 GSK3B (0.39) GSK3BKDRFLT1ABCG2TAS2R14
SCHEMBL22556511 0.87 FLT1 (0.34) GSK3BKDRFLT1AKR1C3
SCHEMBL30463757 0.87 FLT1 (0.34) GSK3BKDRFLT1AKR1C3
SCHEMBL22556514 0.87 FLT1 (0.34) GSK3BKDRFLT1AKR1C3
SCHEMBL22556532 0.81 GSK3B (0.38) GSK3BKDRFLT1ABCG2TAS2R14
SCHEMBL22556476 0.81 GSK3B (0.43) GSK3BKDRFLT1ABCG2TAS2R14
SCHEMBL30323588 0.81 GSK3B (0.43) GSK3BKDRFLT1ABCG2TAS2R14
SCHEMBL22556499 0.80 FLT1 (0.39) GSK3BKDRFLT1ABCG2TAS2R14

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 8 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-11661403-B2 Oxadiazole compounds VIVACE THERAPEUTICS, INC. (US) 2023-05-30 — — US disclosed
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
US-20210238154-A1 OXADIAZOLE COMPOUNDS VIVACE THERAPEUTICS, INC. 2021-08-05 — — US disclosed
EP-3793551-A1 OXADIAZOLE COMPOUNDS Vivace Therapeutics, Inc. (US) 2021-03-24 — — EP disclosed
WO-2019222431-A9 OXADIAZOLE COMPOUNDS VIVACE THERAPEUTICS, INC. (US) 2020-10-22 — — WO disclosed
WO-2019222431-A9 OXADIAZOLE COMPOUNDS VIVACE THERAPEUTICS, INC. (US) 2020-10-22 — — 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 (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 GSK3B 193/4885KDR 1811/4885FLT1 2445/4885
US-11661403-B2 Oxadiazole compounds YAP1, TEAD2, TEAD3 GSK3B 193/4885KDR 1811/4885FLT1 2445/4885

“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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