SCHEMBL21053183

SCHEMBL21053183

O=C(NNC(=O)C1CC1)c1cc(Br)ccc1Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MPO P05164 1/20 0.51
▸ AKR1C3 P42330 2/20 0.46
▸ AKR1C2 P52895 2/20 0.46
▸ RXFP1 Q9HBX9 7/20 0.45
▸ KDM1A O60341 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ TAS2R14 Q9NYV8 1/20 0.41
▸ TMPRSS4 Q9NRS4 1/20 0.40
▸ LIPC P11150 1/20 0.40
▸ LIPG Q9Y5X9 1/20 0.40
▸ KCNK2 O95069 1/20 0.39
▸ KCNK10 P57789 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ KMT2A Q03164 1/20 0.38

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
SCHEMBL22571356 0.84 MPO (0.52) MPOAKR1C3AKR1C2RXFP1KDM1A
SCHEMBL21053197 0.80 MPO (0.55) MPOAKR1C3AKR1C2RXFP1KDM1A
SCHEMBL11435538 0.72 EGFR (0.51) AKR1C3AKR1C2RXFP1MEN1TSHR
SCHEMBL22556334 0.71 RXFP1 (0.53) RXFP1TAS2R14MEN1KMT2A
SCHEMBL23701602 0.71 RXFP1 (0.53) RXFP1
SCHEMBL22556320 0.71 RXFP1 (0.53) RXFP1
SCHEMBL6440422 0.70 GRIK1 (0.62) MPOAKR1C3AKR1C2KDM1AKCNK2
SCHEMBL6351486 0.70 KCNK2 (0.73) MPOAKR1C3AKR1C2RXFP1KDM1A
SCHEMBL30463796 0.69 KMT2A (0.51) RXFP1KMT2A
SCHEMBL23701612 0.69 RXFP1 (0.50) RXFP1MEN1KMT2A

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 12 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-11524943-B1 Benzocarbonyl compounds VIVACE THERAPEUTICS, INC. (US) 2022-12-13 — — 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
EP-3720430-A1 BENZOCARBONYL COMPOUNDS Vivace Therapeutics, Inc. (US) 2020-10-14 — — EP disclosed
WO-2019113236-A1 BENZOCARBONYL COMPOUNDS VIVACE THERAPEUTICS, INC. (US) 2019-06-13 — — WO disclosed
WO-2019113236-A1 BENZOCARBONYL COMPOUNDS VIVACE THERAPEUTICS, INC. (US) 2019-06-13 — — 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 (3 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-11524943-B1 Benzocarbonyl compounds YAP1, TEAD2, TEAD3 MPO 3634/4885AKR1C3 4086/4885AKR1C2 3536/4885
US-20210238154-A1 OXADIAZOLE COMPOUNDS YAP1, TEAD2, TEAD3 MPO 3523/4885AKR1C3 4073/4885AKR1C2 3589/4885
US-11661403-B2 Oxadiazole compounds YAP1, TEAD2, TEAD3 MPO 3523/4885AKR1C3 4073/4885AKR1C2 3589/4885

“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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