SCHEMBL22556586

SCHEMBL22556586

CCOC(=O)c1ccccc1Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 6/20 0.56
CDC25A P30304 1/20 0.55
CDC25C P30307 1/20 0.55
DHODH Q02127 1/20 0.54
KDM4E B2RXH2 3/20 0.53
LMNA P02545 2/20 0.53
MAPT P10636 3/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
NPSR1 Q6W5P4 2/20 0.52
TSHR P16473 1/20 0.51
ALOX15 P16050 1/20 0.51
TP53 P04637 1/20 0.51
HTT P42858 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
METTL3 Q86U44 1/20 0.51
ALDH1A1 P00352 1/20 0.51
HPGD P15428 1/20 0.51
MAPK1 P28482 1/20 0.51

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
SCHEMBL28322767 0.88 TSHR (0.56) CDC25BKDM4ELMNAMAPTCYP1A2
SCHEMBL21765032 0.86 MAPT (0.69) KDM4ELMNAMAPTCYP1A2CYP2C9
SCHEMBL10597386 0.86 LMNA (0.71) CDC25BCDC25ACDC25CLMNACYP1A2
SCHEMBL3630708 0.85 KDM4E (0.67) CDC25BCDC25ACDC25CKDM4ELMNA
SCHEMBL2008034 0.84 MAPT (0.71) CDC25BCDC25ACDC25CKDM4ELMNA
SCHEMBL10833818 0.83 CDC25B (0.65) CDC25BCDC25ACDC25CKDM4ELMNA
SCHEMBL10631533 0.82 LMNA (0.78) LMNAMAPTCYP1A2CYP2C9CYP2C19
SCHEMBL22556332 0.81 NPSR1 (0.47) DHODHKDM4ELMNAMAPTNPSR1
SCHEMBL10834780 0.81 ALDH1A1 (0.65) CDC25BCDC25ACDC25CDHODHKDM4E
SCHEMBL25279533 0.80 AKR1C3 (0.60) MAPTHTTTAS2R14

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 CDC25B 1110/4885CDC25A 1137/4885CDC25C 526/4885
US-11661403-B2 Oxadiazole compounds YAP1, TEAD2, TEAD3 CDC25B 1110/4885CDC25A 1137/4885CDC25C 526/4885

“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.