SCHEMBL24670003

SCHEMBL24670003

O=C1CCC(N2C(=O)c3ccc(N4CCC(N5CC(C(=O)O)C5)CC4)cc3C2=O)C(=O)N1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 18/20 0.71
DDB1 Q16531 11/20 0.54
ALDH1A1 P00352 1/20 0.52
CHRM2 P08172 1/20 0.52
OPRM1 P35372 1/20 0.52
IKZF3 Q9UKT9 1/20 0.52
CYP1A2 P05177 1/20 0.52
TSHR P16473 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
HPGDS O60760 2/20 0.51
AR P10275 2/20 0.50
IKZF1 Q13422 1/20 0.48
IKZF2 Q9UKS7 1/20 0.48

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
SCHEMBL30312919 1.00 CRBN (0.71) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL30043230 1.00 CRBN (0.71) CRBNDDB1ALDH1A1CHRM2OPRM1
Hydrochloric Acid SCHEMBL29207810 0.99 CRBN (0.70) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL22326213 0.92 CRBN (0.77) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL20046223 0.90 CRBN (0.71) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL24832995 0.90 CRBN (0.71) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL24352301 0.90 CRBN (0.71) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL30680834 0.90 CRBN (0.71) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL24735582 0.90 CRBN (0.65) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29841305 0.90 CRBN (0.65) CRBNDDB1ALDH1A1CHRM2OPRM1

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-20230142629-A1 BIFUNCTIONAL DEGRADERS OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASES AND THERAPEUTIC USE THEREOF GILEAD SCIENCES, INC. 2023-05-11 US disclosed
US-20230142629-A1 BIFUNCTIONAL DEGRADERS OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASES AND THERAPEUTIC USE THEREOF GILEAD SCIENCES, INC. 2023-05-11 US disclosed
WO-2022235715-A1 COMPOUNDS FOR INHIBITING OR DEGRADING ITK, COMPOSITIONS, COMPRISING THE SAME METHODS OF THEIR MAKING AND METHODS OF THEIR USE NURIX THERAPEUTICS, INC. (US) 2022-11-10 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 (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-20230142629-A1 BIFUNCTIONAL DEGRADERS OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASES AND THERAPEUTIC USE THEREOF IRAK1, IRAK2, IRAK4 CRBN 324/4885DDB1 661/4885ALDH1A1 1632/4885

“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.