SCHEMBL24711475

SCHEMBL24711475

O=C(Nc1ccc(N2CCN(C(=O)c3cccs3)CC2)cc1)c1ccc(Br)c2ccccc12

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.62
▸ MAPT P10636 10/20 0.60
▸ HTT P42858 2/20 0.60
▸ POLB P06746 2/20 0.60
▸ ALDH1A1 P00352 3/20 0.59
▸ KDM4E B2RXH2 1/20 0.59
▸ LMNA P02545 1/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ PAX8 Q06710 1/20 0.55
▸ NPC1 O15118 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.54

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
SCHEMBL24710759 0.94 KMT2A (0.64) KMT2AMAPTHTTPOLBALDH1A1
SCHEMBL24711761 0.88 KMT2A (0.62) KMT2AMAPTHTTPOLBALDH1A1
SCHEMBL24710977 0.88 KMT2A (0.67) KMT2AMAPTHTTPOLBALDH1A1
SCHEMBL24710811 0.87 MAPT (0.61) KMT2AMAPTHTTPOLBALDH1A1
SCHEMBL24711211 0.86 KMT2A (0.66) KMT2AMAPTHTTPOLBALDH1A1
SCHEMBL24711254 0.86 KMT2A (0.65) KMT2AMAPTHTTPOLBALDH1A1
SCHEMBL24711480 0.86 KMT2A (0.62) KMT2AMAPTHTTPOLBALDH1A1
SCHEMBL24711233 0.81 MAPT (0.70) KMT2AMAPTHTTPOLBALDH1A1
SCHEMBL24710956 0.78 KMT2A (0.68) KMT2AMAPTHTTPOLBALDH1A1
SCHEMBL24711245 0.78 PAX8 (0.73) KMT2AMAPTHTTPOLBALDH1A1

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 KMT2A 3862/4885MAPT 4038/4885HTT 4039/4885

“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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