SCHEMBL31134426

SCHEMBL31134426

Cc1cn(C2CCC(=O)NC2=O)c2cccc(N3CCNCC3)c12

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 3/20 0.45
▸ CRBN Q96SW2 14/20 0.44
▸ DDB1 Q16531 13/20 0.44
▸ IKZF3 Q9UKT9 3/20 0.44
▸ ADRB1 P08588 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.38
▸ CHRM2 P08172 1/20 0.38
▸ OPRM1 P35372 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ TNF P01375 1/20 0.38
▸ IL1B P01584 1/20 0.38

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
SCHEMBL29079587 0.81 CRBN (0.50) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL31134471 0.80 DDB1 (0.47) HTR6CRBNDDB1IKZF3ADRB1
SCHEMBL31628419 0.79 DDB1 (0.43) CRBNDDB1ALDH1A1
SCHEMBL26067471 0.78 CRBN (0.47) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL22836040 0.74 DDB1 (0.61) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL31160682 0.74 DDB1 (0.61) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL20812174 0.74 CRBN (0.62) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL31712330 0.74 CRBN (0.43) HTR6CRBNDDB1IKZF3ADRB1
SCHEMBL31152738 0.74 HTR6 (0.50) HTR6CRBNDDB1IKZF3ALDH1A1
Hydrochloric Acid SCHEMBL26099157 0.74 DDB1 (0.60) CRBNDDB1IKZF3ALDH1A1CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4688149-A1 IRAK4 PROTACS Astrazeneca AB (SE) 2026-02-11 — — EP disclosed
US-20250197411-A1 IRAK4 PROTACS ASTRAZENECA AB (SE) 2025-06-19 — — US disclosed
WO-2025125575-A1 IRAK4 PROTACS ASTRAZENECA AB (SE) 2025-06-19 — — WO disclosed
US-20240374588-A1 IRAK4 PROTACS ASTRAZENECA AB (SE) 2024-11-14 — — US disclosed
WO-2024209044-A1 IRAK4 PROTACS ASTRAZENECA AB (SE) 2024-10-10 — — 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 (2 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-20250197411-A1 IRAK4 PROTACS IRAK4, IRAK2, IRAK3 HTR6 3142/4885CRBN 94/4885DDB1 750/4885
US-20240374588-A1 IRAK4 PROTACS IRAK4, IRAK2, IRAK3 HTR6 3147/4885CRBN 99/4885DDB1 728/4885

“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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