SCHEMBL14810076

SCHEMBL14810076

Nc1ccc(-c2cccc(C(=O)Nc3ccc4nc(N5CCOCC5)sc4c3)n2)cn1

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 7/20 0.70
RAB9A P51151 6/20 0.49
NPC1 O15118 5/20 0.49
SMN1; SMN2 Q16637 2/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
DUSP3 P51452 1/20 0.45
PTPN5 P54829 1/20 0.45
PTPN11 Q06124 1/20 0.45
AR P10275 1/20 0.45

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
SCHEMBL21106090 0.94 IRAK4 (0.69) IRAK4RAB9ANPC1GAA
SCHEMBL16896618 0.88 IRAK4 (0.61) IRAK4RAB9ANPC1GAA
SCHEMBL29662196 0.88 IRAK4 (0.61) IRAK4RAB9ANPC1GAA
SCHEMBL16907800 0.88 IRAK4 (0.59) IRAK4RAB9ANPC1SMN1; SMN2GAA
SCHEMBL29662233 0.88 IRAK4 (0.59) IRAK4RAB9ANPC1SMN1; SMN2GAA
SCHEMBL14824533 0.84 IRAK4 (0.72) IRAK4RAB9ANPC1KMT2ADUSP3
SCHEMBL14811263 0.84 IRAK4 (0.54) IRAK4RAB9ANPC1KMT2ADUSP3
SCHEMBL16896435 0.84 IRAK4 (0.59) IRAK4RAB9ANPC1GAA
SCHEMBL29662205 0.84 IRAK4 (0.59) IRAK4RAB9ANPC1GAA
SCHEMBL14809885 0.82 IRAK4 (0.56) IRAK4RAB9ANPC1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides ARVINAS OPERATIONS, INC. (US) 2024-07-16 US disclosed
US-20220331297-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE 4 POLYPEPTIDES ARVINAS OPERATIONS, INC. 2022-10-20 US disclosed
US-11065231-B2 Compounds and methods for the targeted degradation of interleukin-1 receptor- associated kinase 4 polypeptides ARVINAS OPERATIONS, INC. (US) 2021-07-20 US disclosed
EP-3710443-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE 4 POLYPEPTIDES Arvinas Operations, Inc. (US) 2020-09-23 EP disclosed
US-20200069668-A1 Therapeutic Combinations of an IRAK4 Inhibitor and a BTK Inhibitor ACERTA PHARMA BV (NL) 2020-03-05 US disclosed
US-20190151295-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE 4 POLYPEPTIDES ARVINAS OPERATIONS, INC. 2019-05-23 US disclosed
US-20170035881-A1 Therapeutic Combinations of an IRAK4 Inhibitor and a BTK Inhibitor ACERTA PHARMA BV (NL) 2017-02-09 US disclosed
US-20170035881-A1 Therapeutic Combinations of an IRAK4 Inhibitor and a BTK Inhibitor ACERTA PHARMA BV (NL) 2017-02-09 US disclosed
WO-2013042137-A1 BICYCLIC HETEROCYCLES AS IRAK4 INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2013-03-28 WO disclosed
WO-2013042137-A1 BICYCLIC HETEROCYCLES AS IRAK4 INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2013-03-28 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 (6 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-20190151295-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE 4 POLYPEPTIDES IRAK1, IRAK4, IRAK2 IRAK4 2/4885RAB9A 3342/4885NPC1 2062/4885
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 IRAK4 2/4885RAB9A 3109/4885NPC1 2447/4885
US-11065231-B2 Compounds and methods for the targeted degradation of interleukin-1 receptor- associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 IRAK4 2/4885RAB9A 3342/4885NPC1 2062/4885
US-20220331297-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE 4 POLYPEPTIDES IRAK1, IRAK4, IRAK2 IRAK4 2/4885RAB9A 3342/4885NPC1 2062/4885
US-20170035881-A1 Therapeutic Combinations of an IRAK4 Inhibitor and a BTK Inhibitor IRAK4, IRAK1, IRAK2 IRAK4 1/4885RAB9A 3475/4885NPC1 2793/4885
US-20200069668-A1 Therapeutic Combinations of an IRAK4 Inhibitor and a BTK Inhibitor IRAK4, IRAK1, IRAK2 IRAK4 1/4885RAB9A 3475/4885NPC1 2793/4885

“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.