SCHEMBL632527

SCHEMBL632527

COCCCN1C(=O)CCC(N2Cc3c(csc3N)C2=O)C1=O

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 3/20 0.32
HDAC6 Q9UBN7 4/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
DDB1 Q16531 2/20 0.31
BRD4 O60885 1/20 0.31
TNF P01375 1/20 0.31
IL1B P01584 1/20 0.31
IKZF1 Q13422 1/20 0.31
IKZF3 Q9UKT9 1/20 0.31
MAP1LC3B Q9GZQ8 1/20 0.30
HDAC1 Q13547 1/20 0.30

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
SCHEMBL633006 0.89 CYP19A1 (0.37) CRBNHDAC6MEN1KMT2ADDB1
SCHEMBL632635 0.87 ALDH1A1 (0.34) CRBNHDAC6KMT2ADDB1BRD4
SCHEMBL633122 0.86 CRBN (0.35) CRBNDDB1BRD4TNFIL1B
SCHEMBL633378 0.84 SMN1; SMN2 (0.34) CRBNHDAC6DDB1BRD4TNF
SCHEMBL632788 0.84 CRBN (0.34) CRBNMEN1KMT2ADDB1BRD4
SCHEMBL633625 0.83 ALDH1A1 (0.33) CRBNHDAC6MEN1KMT2ADDB1
SCHEMBL632755 0.82 CRBN (0.31) CRBNDDB1BRD4TNFIL1B
SCHEMBL633548 0.81 CYP2C19 (0.39) MEN1KMT2ATNFMAP1LC3B
SCHEMBL6755164 0.81 TNF (0.30) CRBNDDB1TNFIL1BIKZF1
SCHEMBL633070 0.80 CRBN (0.32) CRBNHDAC6

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
EP-2093228-B1 PYRROLINE-2-ONE DERIVATIVES AGAINST CELL RELEASING TUMOR NECROSIS FACTOR, PREPARATION METHODS AND USES THEREOF TIANJIN HEMAY BIO TECH CO LTD (CN) 2012-02-22 EP disclosed
US-20100152240-A1 PYRROLINE-2-ONE DERIVATIVES AGAINST CELL RELEASING TUMOR NECROSIS FACTOR, PREPARATION METHODS AND USES THEREOF ZHANG HESHENG 2010-06-17 US disclosed
EP-2093228-A1 PYRROLINE-2-ONE DERIVATIVES AGAINST CELL RELEASING TUMOR NECROSIS FACTOR, PREPARATION METHODS AND USES THEREOF Tianjin Hemey Bio-Tech Co., Ltd. (CN) 2009-08-26 EP 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-20100152240-A1 PYRROLINE-2-ONE DERIVATIVES AGAINST CELL RELEASING TUMOR NECROSIS FACTOR, PREPARATION METHODS AND USES THEREOF TNF, IL1B, CYC1 CRBN 2750/4885HDAC6 2593/4885MEN1 1165/4885

“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.