SCHEMBL20990626

SCHEMBL20990626

O=C1CCC(N2Cc3c(OCC4CCCOC4)cccc3C2O)C(=O)N1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 12/20 0.42
▸ IKZF3 Q9UKT9 6/20 0.42
▸ TNF P01375 6/20 0.40
▸ DDB1 Q16531 5/20 0.40
▸ IL1B P01584 3/20 0.40
▸ IKZF1 Q13422 1/20 0.40
▸ BRD4 O60885 1/20 0.40
▸ MAP1LC3B Q9GZQ8 1/20 0.37
▸ HDAC3 O15379 1/20 0.36
▸ HDAC1 Q13547 1/20 0.36

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
SCHEMBL2250730 0.80 CRBN (0.64) CRBNIKZF3TNFDDB1IL1B
SCHEMBL18975947 0.79 CRBN (0.53) CRBNIKZF3TNFDDB1IL1B
SCHEMBL24818018 0.79 CRBN (0.48) CRBNIKZF3TNFDDB1IL1B
SCHEMBL19646674 0.79 CRBN (0.42) CRBNIKZF3TNFDDB1IL1B
SCHEMBL21906782 0.79 CRBN (0.46) CRBNIKZF3TNFDDB1IL1B
SCHEMBL22857769 0.78 CRBN (0.46) CRBNIKZF3TNFDDB1IL1B
SCHEMBL21897792 0.78 CRBN (0.46) CRBNIKZF3DDB1
SCHEMBL20759933 0.78 CRBN (0.45) CRBNIKZF3TNFDDB1IL1B
SCHEMBL19222352 0.78 CRBN (0.66) CRBNIKZF3TNFDDB1IL1B
SCHEMBL19541974 0.77 CRBN (0.49) CRBNIKZF3TNFDDB1IL1B

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-10669257-B2 Arylmethoxy isoindoline derivatives and compositions comprising and methods of using the same CELGENE CORPORATION (US) 2020-06-02 — — US disclosed
US-20190135780-A1 ARYLMETHOXY ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME CELGENE CORPORATION 2019-05-09 — — 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 (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-10669257-B2 Arylmethoxy isoindoline derivatives and compositions comprising and methods of using the same CYP3A7, CYP3A4, CYP3A43 CRBN 2429/4885IKZF3 2341/4885TNF 4590/4885
US-20190135780-A1 ARYLMETHOXY ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME CYP3A7, CYP3A4, CYP3A43 CRBN 2429/4885IKZF3 2341/4885TNF 4590/4885

“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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