SCHEMBL17373873

SCHEMBL17373873

CC(C)(C)[Si](C)(C)O[C@H]1CCN(c2cc3cnn(C4CC4)c3cc2[N+](=O)[O-])C1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ GAA P10253 2/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ HTT P42858 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ GPR119 Q8TDV5 4/20 0.32
▸ TP53 P04637 3/20 0.32
▸ POLB P06746 1/20 0.32
▸ GPR174 Q9BXC1 2/20 0.31

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
SCHEMBL17373875 1.00 MAPT (0.34) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL17373888 0.89 KMT2A (0.35) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL17373886 0.89 KMT2A (0.35) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL17373883 0.86 ALDH1A1 (0.34) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL17373880 0.86 ALDH1A1 (0.34) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL18207832 0.85 KMT2A (0.35) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL18207831 0.85 KMT2A (0.35) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL17373816 0.84 GPR119 (0.31) GPR119
SCHEMBL17373815 0.84 GPR119 (0.31) GPR119
SCHEMBL17373952 0.80 MEN1 (0.36) MAPTALDH1A1GAAMEN1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170152263-A1 Substituted Indazole Compounds as IRAK4 Inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2017-06-01 — — US disclosed
EP-3157521-A1 SUBSTITUTED INDAZOLE COMPOUNDS AS IRAK4 INHIBITORS Aurigene Discovery Technologies Limited (IN) 2017-04-26 — — EP disclosed
WO-2015193846-A1 SUBSTITUTED INDAZOLE COMPOUNDS AS IRAK4 INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2015-12-23 — — WO 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-20170152263-A1 Substituted Indazole Compounds as IRAK4 Inhibitors IRAK4, IRAK3, IRAK2 MAPT 1391/4885ALDH1A1 1980/4885GAA 3405/4885

“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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