SCHEMBL632788

SCHEMBL632788

CCN1C(=O)CCC(N2Cc3c(csc3N)C2=O)C1=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 6/20 0.34
DDB1 Q16531 2/20 0.34
BRD4 O60885 1/20 0.34
TNF P01375 1/20 0.34
IL1B P01584 1/20 0.34
IKZF1 Q13422 1/20 0.34
IKZF3 Q9UKT9 1/20 0.34
ALOX15 P16050 1/20 0.32
MAP1LC3B Q9GZQ8 1/20 0.32
MAPK1 P28482 1/20 0.31
HSD17B10 Q99714 1/20 0.31
DRD4 P21917 2/20 0.30
ALDH1A1 P00352 2/20 0.30
RAB9A P51151 1/20 0.30
TSHR P16473 1/20 0.30
HTT P42858 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 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
SCHEMBL633122 0.91 CRBN (0.35) CRBNDDB1BRD4TNFIL1B
SCHEMBL633006 0.89 CYP19A1 (0.37) CRBNDDB1BRD4TNFIL1B
SCHEMBL633378 0.86 SMN1; SMN2 (0.34) CRBNDDB1BRD4TNFIL1B
SCHEMBL633406 0.86 CRBN (0.32) CRBNDDB1BRD4TNFIL1B
SCHEMBL3339484 0.85 GAA (0.38) HSD17B10ALDH1A1RAB9AHTTKDM4E
SCHEMBL633625 0.85 ALDH1A1 (0.33) CRBNDDB1BRD4TNFIL1B
SCHEMBL632635 0.84 ALDH1A1 (0.34) CRBNDDB1BRD4TNFIL1B
SCHEMBL632820 0.84 CRBN (0.33) CRBN
SCHEMBL632755 0.84 CRBN (0.31) CRBNDDB1BRD4TNFIL1B
SCHEMBL632527 0.84 CRBN (0.32) CRBNDDB1BRD4TNFIL1B

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 2750/4885DDB1 1368/4885BRD4 1875/4885

“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.