SCHEMBL25586729

SCHEMBL25586729

C[C@H]1COc2ccc(C#Cc3cccnc3)cc2N(C)C1=O

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 18/20 0.56
▸ GRM5 P41594 2/20 0.43

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
SCHEMBL25878873 0.88 RIPK1 (0.55) RIPK1GRM5
SCHEMBL23085493 0.86 RIPK1 (0.65) RIPK1
SCHEMBL30387134 0.80 RIPK1 (0.47) RIPK1GRM5
SCHEMBL25584836 0.80 RIPK1 (0.47) RIPK1GRM5
SCHEMBL24075996 0.79 RIPK1 (0.63) RIPK1
SCHEMBL24076821 0.78 RIPK1 (0.51) RIPK1
SCHEMBL25586394 0.78 RIPK1 (0.46) RIPK1
SCHEMBL26381841 0.76 RIPK1 (0.56) RIPK1
SCHEMBL24075984 0.76 RIPK1 (0.64) RIPK1
SCHEMBL31656021 0.75 RIPK1 (0.68) RIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230167129-A1 HETEROCYCLIC AMIDE FOR INHIBITING RIP1 KINASE AND USES THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2023-06-01 — — 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 (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-20230167129-A1 HETEROCYCLIC AMIDE FOR INHIBITING RIP1 KINASE AND USES THEREOF RIPK1, RIPK3, RIPK4 RIPK1 1/4885GRM5 3049/4885

“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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