SCHEMBL2031010

SCHEMBL2031010

CCOC(=O)c1ccc2c(c1)nc(N)n2[C@H]1CC[C@H](O)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RPS6KB1 P23443 1/20 0.49
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ GRK6 P43250 1/20 0.46
▸ MAPT P10636 5/20 0.45
▸ NLRP3 Q96P20 1/20 0.45
▸ ALDH1A1 P00352 4/20 0.45
▸ NPSR1 Q6W5P4 2/20 0.45
▸ GAA P10253 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ SIRT2 Q8IXJ6 4/20 0.45
▸ SIRT1 Q96EB6 4/20 0.45
▸ KDM4E B2RXH2 1/20 0.44
▸ USP2 O75604 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL2031012 1.00 RPS6KB1 (0.49) RPS6KB1NPC1RAB9AMEN1KMT2A
SCHEMBL21310910 0.91 GRK6 (0.46) RPS6KB1NPC1RAB9AMEN1KMT2A
SCHEMBL2030741 0.90 L3MBTL1 (0.57) RPS6KB1NPC1RAB9AMEN1KMT2A
SCHEMBL22382488 0.88 RPS6KB1 (0.51) RPS6KB1NPC1RAB9AMEN1KMT2A
SCHEMBL21311021 0.88 RPS6KB1 (0.57) RPS6KB1L3MBTL1KDM4EEGFR
SCHEMBL2032453 0.85 RPS6KB1 (0.47) RPS6KB1NPC1RAB9AMEN1KMT2A
SCHEMBL2032449 0.85 RPS6KB1 (0.47) RPS6KB1NPC1RAB9AMEN1KMT2A
SCHEMBL17582784 0.82 RPS6KB1 (0.48) RPS6KB1NPC1GRK6MAPTALDH1A1
SCHEMBL21310911 0.81 ALDH1A1 (0.52) RPS6KB1GRK6MAPTALDH1A1L3MBTL1
SCHEMBL22382307 0.79 KMT2A (0.63) NPC1RAB9AMEN1KMT2AMAPT

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-8293923-B2 Indazole derivatives as modulators of interleukin-1 receptor-associated kinase BIOGEN IDEC MA INC. (US) 2012-10-23 — — US disclosed
US-20110152260-A1 Indazole derivatives as modulators of interleukin-1 receptor-associated kinase BIOGEN IDEC MA INC. (US) 2011-06-23 — — 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-20110152260-A1 Indazole derivatives as modulators of interleukin-1 receptor-associated kinase IRAK1, IRAK2, IRAK3 RPS6KB1 147/4885NPC1 937/4885RAB9A 2682/4885

“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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