SCHEMBL21296766

SCHEMBL21296766

CC(C)(C)OC(=O)n1nccc1-c1ccccc1N

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.41
SMARCA2 P51531 2/20 0.41
SMARCA4 P51532 2/20 0.41
PBRM1 Q86U86 2/20 0.41
BCHE P06276 1/20 0.37
HDAC1 Q13547 4/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
ABCB1 P08183 1/20 0.36
ELANE P08246 1/20 0.35
MAPK1 P28482 1/20 0.34
GPR119 Q8TDV5 1/20 0.34
IDO1 P14902 1/20 0.34
NR1H2 P55055 1/20 0.34
RORC P51449 1/20 0.34
POLB P06746 1/20 0.33
FAAH O00519 1/20 0.33
TNK2 Q07912 1/20 0.33

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
SCHEMBL21296782 0.80 PDE4B (0.41) USP30
SCHEMBL9909930 0.78 NR1H2 (0.39) USP30HDAC1HSP90AA1HSP90AB1ELANE
SCHEMBL21296771 0.76 MAP2K4 (0.39) USP30HSP90AA1HSP90AB1NR1H2
SCHEMBL1864917 0.76 FAAH (0.40) USP30SMARCA2SMARCA4PBRM1BCHE
SCHEMBL4237117 0.75 SMARCA2 (0.40) SMARCA2SMARCA4PBRM1BCHEHDAC1
SCHEMBL23610579 0.74 ELANE (0.41) HDAC1ABCB1ELANE
SCHEMBL4951116 0.72 KDM5A (0.40) USP30ELANENR1H2RORCFAAH
SCHEMBL22165763 0.72 ROCK2 (0.48) SMARCA2SMARCA4PBRM1BCHEHDAC1
SCHEMBL693588 0.71 FAAH (0.41) USP30BCHEABCB1ELANEMAPK1
SCHEMBL23610578 0.71 KMT2A (0.54) HDAC1ABCB1ELANEPOLB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11530181-B2 IL-6 inhibitors and methods of treatment UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2022-12-20 US disclosed
US-20210206718-A1 IL-6 INHIBITORS AND METHODS OF TREATMENT UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2021-07-08 US disclosed
WO-2019165158-A1 IL-6 INHIBITORS AND METHODS OF TREATMENT UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2019-08-29 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-11530181-B2 IL-6 inhibitors and methods of treatment IL6, IL6ST, IL2 USP30 1921/4885SMARCA2 4325/4885SMARCA4 4345/4885
US-20210206718-A1 IL-6 INHIBITORS AND METHODS OF TREATMENT IL6, IL6ST, IL2 USP30 1921/4885SMARCA2 4325/4885SMARCA4 4345/4885

“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.