SCHEMBL25554155

SCHEMBL25554155

CNC1CCc2ccncc2N(C)C1=O

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 9/20 0.45
▸ HTR2A P28223 1/20 0.39
▸ HTR2C P28335 1/20 0.39
▸ HTR2B P41595 1/20 0.39
▸ ADORA3 P0DMS8 1/20 0.38
▸ ADORA2A P29274 1/20 0.38
▸ XIAP P98170 3/20 0.38
▸ PDPK1 O15530 1/20 0.36
▸ PYGL P06737 1/20 0.35
▸ PYGM P11217 1/20 0.35
▸ CHRNB2 P17787 1/20 0.35
▸ CHRNA7 P36544 1/20 0.35
▸ CHRNA4 P43681 1/20 0.35

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
SCHEMBL25551278 0.81 HDAC6 (0.44) RIPK1HTR2AHTR2CHTR2BADORA3
SCHEMBL25565448 0.76 RIPK1 (0.43) RIPK1HTR2AHTR2CHTR2BADORA3
SCHEMBL19496039 0.72 CYP11B1 (0.55) ADORA3ADORA2A
SCHEMBL19255133 0.72 RIPK1 (0.55) RIPK1HTR2AHTR2CHTR2BPDPK1
SCHEMBL19255762 0.71 RIPK1 (0.54) RIPK1
SCHEMBL25556119 0.70 CYP11B1 (0.46) ADORA3ADORA2ACHRNB2CHRNA4
SCHEMBL25585078 0.69 RIPK1 (0.41) RIPK1
SCHEMBL23905992 0.69 PDPK1 (0.58) PDPK1CHRNB2CHRNA7CHRNA4
SCHEMBL15222076 0.68 HTR2A (0.46) HTR2AHTR2CHTR2BCHRNB2CHRNA7
SCHEMBL21734377 0.68 ALDH1A1 (0.36) RIPK1PDPK1

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 RIPK1 1/4885HTR2A 3040/4885HTR2C 3753/4885

“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.

Send feedback