SCHEMBL20985355

SCHEMBL20985355

O=C(Nc1nc2cc(CN3CCNCC3)ccc2n1-c1ccccc1)c1cccc(C(F)(F)F)c1

nearest known ligand 0.86

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 8/20 0.86
MAP3K7 O43318 7/20 0.86
IRAK1 P51617 5/20 0.86
CHRM3 P20309 2/20 0.55
EGFR P00533 7/20 0.52
SLC2A1 P11166 1/20 0.47
ACKR3 P25106 1/20 0.44
RPS6KA3 P51812 1/20 0.43
RPS6KA2 Q15349 1/20 0.43

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
SCHEMBL29313973 0.93 IRAK4 (0.74) IRAK4MAP3K7IRAK1CHRM3EGFR
SCHEMBL1924466 0.92 MAP3K7 (1.00) IRAK4MAP3K7IRAK1EGFRACKR3
SCHEMBL29313978 0.92 MAP3K7 (0.73) IRAK4MAP3K7IRAK1CHRM3EGFR
SCHEMBL29313956 0.91 IRAK4 (0.85) IRAK4MAP3K7IRAK1EGFRACKR3
SCHEMBL21025639 0.91 IRAK4 (0.71) IRAK4MAP3K7IRAK1CHRM3EGFR
SCHEMBL29313950 0.90 IRAK4 (0.82) IRAK4MAP3K7IRAK1EGFRACKR3
SCHEMBL21025910 0.88 IRAK4 (0.67) IRAK4MAP3K7IRAK1CHRM3EGFR
SCHEMBL29313489 0.87 IRAK4 (0.66) IRAK4MAP3K7IRAK1CHRM3EGFR
SCHEMBL1923717 0.86 MAP3K7 (0.88) IRAK4MAP3K7IRAK1CHRM3EGFR
SCHEMBL20985396 0.86 IRAK4 (0.76) IRAK4MAP3K7IRAK1EGFRACKR3

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 9 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-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-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
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-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-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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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 2/4885MAP3K7 536/4885IRAK1 1/4885
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 IRAK4 2/4885MAP3K7 533/4885IRAK1 1/4885
US-11065231-B2 Compounds and methods for the targeted degradation of interleukin-1 receptor- associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 IRAK4 2/4885MAP3K7 536/4885IRAK1 1/4885
US-20220331297-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE 4 POLYPEPTIDES IRAK1, IRAK4, IRAK2 IRAK4 2/4885MAP3K7 536/4885IRAK1 1/4885

“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.