SCHEMBL20697118

SCHEMBL20697118

CN(C(=O)OC(C)(C)C)c1cc(Nc2cccn(-c3ccc(F)cc3)c2=O)nc2c(C(=O)O)ccn12

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 16/20 0.47
▸ RIPK3 Q9Y572 3/20 0.35
▸ MET P08581 3/20 0.35
▸ RIPK2 O43353 1/20 0.35
▸ RIPK1 Q13546 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
SCHEMBL20697119 0.90 TYK2 (0.44) TYK2RIPK3METRIPK2
SCHEMBL20697113 0.89 TYK2 (0.57) TYK2
SCHEMBL20689403 0.88 TYK2 (0.58) TYK2
SCHEMBL20689401 0.80 TYK2 (0.54) TYK2
SCHEMBL20689402 0.79 TYK2 (0.70) TYK2
SCHEMBL21227563 0.75 TYK2 (0.68) TYK2
SCHEMBL20697404 0.73 TYK2 (0.52) TYK2
SCHEMBL20689031 0.72 TYK2 (0.51) TYK2
SCHEMBL20689507 0.71 TYK2 (0.48) TYK2
SCHEMBL362582 0.62 LMNA (0.57) RIPK3METRIPK2

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-11046698-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2021-06-29 — — US disclosed
US-20190031664-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-01-31 — — 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-11046698-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 TYK2 1/4885RIPK3 183/4885MET 3604/4885
US-20190031664-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 TYK2 1/4885RIPK3 183/4885MET 3604/4885

“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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