SCHEMBL25551990

SCHEMBL25551990

COc1cnc(C(=O)O)nc1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
KMT2A Q03164 1/20 0.46
RECQL P46063 1/20 0.44
KMO O15229 2/20 0.44
HSP90AA1 P07900 1/20 0.43
KDM4E B2RXH2 2/20 0.42
GAA P10253 2/20 0.42
LMNA P02545 1/20 0.42
HPGD P15428 1/20 0.41
PDK1 Q15118 3/20 0.41
MAPT P10636 3/20 0.41
PDK2 Q15119 1/20 0.41
PDK3 Q15120 1/20 0.41
PDK4 Q16654 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ECE1 P42892 1/20 0.41
GLA P06280 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41

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
SCHEMBL25560072 0.88 ALDH1A1 (0.46) ALDH1A1KMT2ARECQLHSP90AA1KDM4E
SCHEMBL25551995 0.88 ALDH1A1 (0.60) ALDH1A1KMT2ARECQLHSP90AA1MAPT
SCHEMBL25560084 0.83 ALDH1A1 (0.42) ALDH1A1KMT2ARECQLHSP90AA1KDM4E
SCHEMBL24572723 0.79 NTRK1 (0.45) ALDH1A1KMT2AKMOKDM4ELMNA
SCHEMBL25551994 0.79 KMT2A (0.50) ALDH1A1KMT2ARECQLKDM4EGAA
SCHEMBL22837067 0.77 RXRA (0.42) KMOKDM4ELMNAPDGFRBPDGFRA
SCHEMBL25560074 0.77 MAPT (0.54) ALDH1A1KMT2ARECQLKDM4EGAA
SCHEMBL30156974 0.76 KMO (0.44) ALDH1A1KMT2AKMOKDM4EGAA
SCHEMBL25551849 0.76 KMO (0.44) ALDH1A1KMT2AKMOKDM4EGAA
SCHEMBL25560069 0.75 KMT2A (0.46) ALDH1A1KMT2ARECQLHSP90AA1KDM4E

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-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
CN-115515940-A Inhibitors of receptor interacting protein kinase I for the treatment of disease 德州大学系统董事会 2022-12-23 CN 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 ALDH1A1 4554/4885KMT2A 3766/4885RECQL 1991/4885

“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.