SCHEMBL25560575

SCHEMBL25560575

CCc1cnc(C=O)nc1-c1cnc(C)nc1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NOS3 P29474 1/20 0.35
▸ NOS1 P29475 1/20 0.35
▸ NOS2 P35228 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ AOX1 Q06278 1/20 0.31
▸ PDK1 Q15118 1/20 0.31
▸ TRIM24 O15164 1/20 0.30
▸ TRIM33 Q9UPN9 1/20 0.30

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
SCHEMBL25552100 0.79 CYP1A2 (0.33) HPGD
SCHEMBL25559595 0.78 MAPK14 (0.41) MEN1KMT2A
SCHEMBL25560552 0.77 NOS3 (0.33) NOS3NOS1NOS2LMNAPDK1
SCHEMBL25560591 0.73 PDK1 (0.36) NOS3NOS1NOS2ALDH1A1LMNA
SCHEMBL25561261 0.69 MAPK14 (0.39) —
SCHEMBL17773680 0.69 APOBEC3A (0.33) NOS3NOS1NOS2KDM4EMEN1
SCHEMBL25559895 0.67 ALDH1A1 (0.36) KDM4EMEN1ALDH1A1LMNAHPGD
SCHEMBL25559908 0.67 DPP4 (0.37) KDM4EALDH1A1LMNAHPGD
SCHEMBL789028 0.64 — —
SCHEMBL18779341 0.63 PDE10A (0.42) KDM4EMEN1ALDH1A1LMNAHPGD

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-20230159508-A1 INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE I FOR THE TREATMENT OF DISEASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2023-05-25 — — 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-20230159508-A1 INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE I FOR THE TREATMENT OF DISEASE RIPK1, RIPK2, RIPK4 NOS3 3711/4885NOS1 3272/4885NOS2 3880/4885

“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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