SCHEMBL30801298

SCHEMBL30801298

O=C1CC[C@@H](N2Cc3cc(N4CC[C@H](CO)C4)ccc3C2=O)C(=O)N1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 9/20 0.61
▸ ESR1 P03372 1/20 0.53
▸ CSNK1A1 P48729 1/20 0.51
▸ WIZ O95785 1/20 0.49
▸ IKZF2 Q9UKS7 9/20 0.49
▸ IKZF1 Q13422 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
SCHEMBL25371673 1.00 CRBN (0.61) CRBNESR1CSNK1A1WIZIKZF2
SCHEMBL29799690 1.00 CRBN (0.61) CRBNESR1CSNK1A1WIZIKZF2
SCHEMBL30680844 1.00 CRBN (0.61) CRBNESR1CSNK1A1WIZIKZF2
SCHEMBL24697760 1.00 CRBN (0.61) CRBNESR1CSNK1A1WIZIKZF2
SCHEMBL26969613 1.00 CRBN (0.61) CRBNESR1CSNK1A1WIZIKZF2
SCHEMBL29614522 0.94 CRBN (0.63) CRBNESR1CSNK1A1WIZIKZF2
SCHEMBL20234982 0.94 CRBN (0.63) CRBNESR1CSNK1A1WIZIKZF2
SCHEMBL21759834 0.93 CRBN (0.64) CRBNESR1CSNK1A1WIZIKZF2
SCHEMBL30646867 0.92 CRBN (0.61) CRBN
SCHEMBL26658628 0.92 CRBN (0.61) CRBN

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-20240279202-A1 COMPOUNDS FOR INHIBITING OR DEGRADING ITK, COMPOSITIONS, COMPRISING THE SAME METHODS OF THEIR MAKING AND METHODS OF THEIR USE NURIX THERAPEUTICS, INC. 2024-08-22 — — US disclosed
CN-117693502-A Compounds for inhibiting or degrading ITK, compositions comprising the same, methods of making the same, and methods of using the same 纽力克斯治疗公司 2024-03-12 — — CN 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-20240279202-A1 COMPOUNDS FOR INHIBITING OR DEGRADING ITK, COMPOSITIONS, COMPRISING THE SAME METHODS OF THEIR MAKING AND METHODS OF THEIR USE ITK, NFATC1, TNIK CRBN 929/4885ESR1 3966/4885CSNK1A1 322/4885

“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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