SCHEMBL20580385

SCHEMBL20580385

CC(C)(C(=O)N1OCC[C@H]1c1cncc(C#N)c1)C1CC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 10/20 0.39
CHRNB4 P30926 4/20 0.36
CHRNA3 P32297 4/20 0.36
CHRNA1 P02708 3/20 0.36
CHRNB2 P17787 3/20 0.36
CHRNA4 P43681 3/20 0.36
CHRNG P07510 1/20 0.36
CHRNB1 P11230 1/20 0.36
CHRND Q07001 1/20 0.36
CHRNA2 Q15822 1/20 0.36
GPR119 Q8TDV5 1/20 0.33
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31

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
SCHEMBL18921369 0.90 RIPK1 (0.40) RIPK1CHRNB4CHRNA3CHRNA1CHRNB2
SCHEMBL20580234 0.89 RIPK1 (0.40) RIPK1CHRNB4CHRNA3CHRNA1CHRNB2
SCHEMBL20580066 0.88 RIPK1 (0.39) RIPK1CHRNB4CHRNA3CHRNA1CHRNB2
SCHEMBL18921255 0.86 RIPK1 (0.40) RIPK1CHRNB4CHRNA3CHRNA1CHRNB2
SCHEMBL20580377 0.86 RIPK1 (0.42) RIPK1CHRNB4CHRNA3CHRNA1CHRNB2
SCHEMBL18921401 0.85 RIPK1 (0.41) RIPK1CHRNB4CHRNA3CHRNA1CHRNB2
SCHEMBL18921399 0.85 RIPK1 (0.41) RIPK1CHRNB4CHRNA3CHRNA1CHRNB2
SCHEMBL29966542 0.85 RIPK1 (0.41) RIPK1CHRNB4CHRNA3CHRNA1CHRNB2
SCHEMBL20580669 0.83 RIPK1 (0.39) RIPK1CHRNB4CHRNA3CHRNA1CHRNB2
SCHEMBL18921452 0.83 RIPK1 (0.43) RIPK1CHRNB4CHRNA3CHRNA1CHRNB2

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-10709692-B2 Isoxazolidine derived inhibitors of receptor interacting protein kinase 1 (RIPK1) DENALI THERAPEUTICS INC. (US) 2020-07-14 US disclosed
US-10709692-B2 Isoxazolidine derived inhibitors of receptor interacting protein kinase 1 (RIPK1) DENALI THERAPEUTICS INC. (US) 2020-07-14 US disclosed
US-20180353480-A1 ISOXAZOLIDINE DERIVED INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE 1 (RIPK1) APTUIT (VERONA) S.R.L. (IT) 2018-12-13 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-20180353480-A1 ISOXAZOLIDINE DERIVED INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE 1 (RIPK1) RIPK1, RIPK2, RIPK3 RIPK1 1/4885CHRNB4 3018/4885CHRNA3 2576/4885
US-10709692-B2 Isoxazolidine derived inhibitors of receptor interacting protein kinase 1 (RIPK1) RIPK1, RIPK2, RIPK3 RIPK1 1/4885CHRNB4 3018/4885CHRNA3 2576/4885

“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.