SCHEMBL24711501

SCHEMBL24711501

COc1ccc(C(=O)Nc2cccc(-c3nc4ncccc4o3)c2)cc1Br

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 3/20 0.84
MAPT P10636 6/20 0.75
SMN1; SMN2 Q16637 4/20 0.75
KDM4E B2RXH2 4/20 0.70
GAA P10253 2/20 0.68
TP53 P04637 7/20 0.67
ALDH1A1 P00352 3/20 0.67
HPGD P15428 3/20 0.67
HSD17B10 Q99714 3/20 0.67
LMNA P02545 2/20 0.67
HTT P42858 2/20 0.67
PKM P14618 1/20 0.60
RXFP1 Q9HBX9 2/20 0.59
NPSR1 Q6W5P4 2/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
POLB P06746 1/20 0.59
NPC1 O15118 1/20 0.59
USP2 O75604 1/20 0.59
TSHR P16473 1/20 0.59

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
SCHEMBL2739985 0.92 SIRT1 (1.00) SIRT1MAPTSMN1; SMN2KDM4EGAA
SCHEMBL2624612 0.89 SIRT1 (0.84) SIRT1MAPTSMN1; SMN2KDM4EGAA
SCHEMBL2739977 0.87 SIRT1 (0.80) SIRT1MAPTSMN1; SMN2KDM4EGAA
SCHEMBL24711187 0.86 SIRT1 (0.79) SIRT1MAPTSMN1; SMN2KDM4EGAA
SCHEMBL2624606 0.86 SIRT1 (0.86) SIRT1MAPTSMN1; SMN2KDM4EGAA
SCHEMBL2739987 0.86 KDM4E (0.80) SIRT1MAPTSMN1; SMN2KDM4EGAA
SCHEMBL5309636 0.85 SIRT1 (0.78) SIRT1MAPTSMN1; SMN2KDM4EGAA
SCHEMBL2739980 0.85 POLB (0.81) SIRT1MAPTSMN1; SMN2KDM4EGAA
SCHEMBL2624527 0.83 SIRT1 (0.75) SIRT1MAPTSMN1; SMN2KDM4EGAA
SCHEMBL2739986 0.83 SIRT1 (0.74) SIRT1MAPTSMN1; SMN2KDM4EGAA

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-20220395500-A1 SMALL MOLECULE ACTIVATORS OF INTERFERON REGULATORY FACTOR 3 AND METHODS OF USE THEREOF NEURALEXO, INC. 2022-12-15 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-20220395500-A1 SMALL MOLECULE ACTIVATORS OF INTERFERON REGULATORY FACTOR 3 AND METHODS OF USE THEREOF IRF3, IRF2BP2, STAT1 SIRT1 1414/4885MAPT 4038/4885SMN1; SMN2 1343/4885

“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.