SCHEMBL4308911

SCHEMBL4308911

Nc1ccc2c(c1)CN([C@@H]1CCC(=O)NC1=O)C2=S

nearest known ligand 0.78

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 16/20 0.78
DDB1 Q16531 4/20 0.57
IKZF2 Q9UKS7 4/20 0.49
IKZF3 Q9UKT9 3/20 0.48
BRD4 O60885 1/20 0.48
TNF P01375 1/20 0.48
IL1B P01584 1/20 0.48
IKZF1 Q13422 1/20 0.48
CSNK1A1 P48729 1/20 0.47

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
SCHEMBL4307565 1.00 CRBN (0.78) CRBNDDB1IKZF2IKZF3BRD4
SCHEMBL4315200 1.00 CRBN (0.78) CRBNDDB1IKZF2IKZF3BRD4
SCHEMBL4307848 0.90 CRBN (0.78) CRBNDDB1IKZF3BRD4TNF
SCHEMBL4307572 0.90 CRBN (0.78) CRBNDDB1IKZF3BRD4TNF
SCHEMBL4307568 0.90 CRBN (0.78) CRBNDDB1IKZF3BRD4TNF
SCHEMBL20234431 0.88 CRBN (1.00) CRBNDDB1IKZF2IKZF3BRD4
SCHEMBL29440001 0.88 CRBN (1.00) CRBNDDB1IKZF2IKZF3BRD4
SCHEMBL501751 0.88 CRBN (1.00) CRBNDDB1IKZF2IKZF3BRD4
SCHEMBL22564891 0.85 CRBN (0.57) CRBNIKZF2CSNK1A1
SCHEMBL20128634 0.82 CRBN (0.76) CRBNDDB1IKZF3BRD4TNF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090298882-A1 THIOXOISOINDOLINE COMPOUNDS AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME CELGENE CORPORATION 2009-12-03 US claimed
WO-2009139880-A1 THIOXOISOINDOLINE COMPOUNDS AND COMPOSITIONS AND METHODS OF USING THE SAME CELGENE CORPORATION (US) 2009-11-19 WO claimed
US-20090298882-A1 THIOXOISOINDOLINE COMPOUNDS AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME CELGENE CORPORATION 2009-12-03 US disclosed
WO-2009139880-A1 THIOXOISOINDOLINE COMPOUNDS AND COMPOSITIONS AND METHODS OF USING THE SAME CELGENE CORPORATION (US) 2009-11-19 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-20090298882-A1 THIOXOISOINDOLINE COMPOUNDS AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME TPMT, CYP3A7, UGT2B7 CRBN 4405/4885DDB1 1975/4885IKZF2 3330/4885

“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.