SCHEMBL22932337

SCHEMBL22932337

CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1cnc(C#N)c(Nc2ccc(C(F)(F)F)cc2)n1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 3/20 0.41
▸ LCK P06239 2/20 0.41
▸ BTK Q06187 1/20 0.41
▸ SYK P43405 2/20 0.39
▸ EGFR P00533 1/20 0.39
▸ DHODH Q02127 2/20 0.39
▸ MAPT P10636 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ JAK2 O60674 6/20 0.36
▸ JAK1 P23458 6/20 0.36
▸ FLT3 P36888 1/20 0.35
▸ LIPE Q05469 1/20 0.35
▸ TRPV1 Q8NER1 1/20 0.34
▸ KDR P35968 1/20 0.34

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
SCHEMBL22932341 0.81 XDH (0.33) LIPE
SCHEMBL29420820 0.76 DHODH (0.46) EGFRDHODHMAPTKDM4ETRPV1
SCHEMBL22932191 0.76 DHODH (0.46) EGFRDHODHMAPTKDM4ETRPV1
SCHEMBL22931761 0.75 FLT3 (0.39) SYKDHODHMAPTJAK2JAK1
SCHEMBL22932340 0.73 SYK (0.46) JAK3BTKSYK
SCHEMBL15741368 0.71 SYK (0.41) SYKDHODHMAPTLIPETRPV1
SCHEMBL16550052 0.71 SYK (0.40) SYKMAPTTRPV1
SCHEMBL29420808 0.68 DHODH (0.44) DHODHMAPTKDM4EJAK2JAK1
SCHEMBL22931805 0.68 DHODH (0.44) DHODHMAPTKDM4EJAK2JAK1
SCHEMBL24755151 0.68 HDAC3 (0.33) LIPE

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-20220402900-A1 1,2,4-OXADIAZOL-5-ONE DERIVATIVES FOR THE TREATMENT OF CANCER BASILEA PHARM INT AG (CH) 2022-12-22 — — US disclosed
WO-2021018869-A1 1,2,4-OXADIAZOL-5-ONE DERIVATIVES FOR THE TREATMENT OF CANCER Basilea Pharmaceutica International AG (CH) 2021-02-04 — — 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 (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-20220402900-A1 1,2,4-OXADIAZOL-5-ONE DERIVATIVES FOR THE TREATMENT OF CANCER OXER1, CBR3, CCNY JAK3 2247/4885LCK 1597/4885BTK 614/4885

“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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