SCHEMBL20892907

SCHEMBL20892907

CC#CC(=O)N1CC[C@H](CC(C)C)C1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BTK Q06187 9/20 0.40
PDE4B Q07343 1/20 0.38
GPX4 P36969 1/20 0.34
DPP4 P27487 3/20 0.33
DPP8 Q6V1X1 2/20 0.33
DPP7 Q9UHL4 1/20 0.33
DPP9 Q86TI2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL20892779 1.00 BTK (0.40) BTKPDE4BGPX4DPP4DPP8
SCHEMBL20892883 0.87 GPX4 (0.34) BTKPDE4BGPX4
SCHEMBL19353417 0.82 BTK (0.42) BTKPDE4BGPX4DPP8DPP7
SCHEMBL19353418 0.82 BTK (0.42) BTKPDE4BGPX4DPP8DPP7
SCHEMBL19353422 0.82 BTK (0.42) BTKPDE4BGPX4DPP8DPP7
SCHEMBL20892778 0.79 BTK (0.41) BTKPDE4BGPX4DPP8DPP7
SCHEMBL17522138 0.78 PIK3CD (0.43) DPP4DPP8DPP7DPP9MEN1
SCHEMBL17522201 0.78 PIK3CD (0.43) DPP4DPP8DPP7DPP9MEN1
SCHEMBL17522199 0.78 PIK3CD (0.43) DPP4DPP8DPP7DPP9MEN1
SCHEMBL20892777 0.77 BTK (0.42) BTKPDE4B

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-10870652-B2 Compounds and methods for modulating bruton's tyrosine kinase CORVUS PHARMACEUTICALS, INC. (US) 2020-12-22 US disclosed
US-20190106423-A1 COMPOUNDS AND METHODS FOR MODULATING BRUTON'S TYROSINE KINASE CORVUS BIOPHARMACEUTICALS, LTD. (KY) 2019-04-11 US 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-20190106423-A1 COMPOUNDS AND METHODS FOR MODULATING BRUTON'S TYROSINE KINASE ABL1, BTK, LYN BTK 2/4885PDE4B 993/4885GPX4 3181/4885
US-10870652-B2 Compounds and methods for modulating bruton's tyrosine kinase ABL1, BTK, LYN BTK 2/4885PDE4B 993/4885GPX4 3181/4885

“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.