SCHEMBL10054602

SCHEMBL10054602

COC(=O)CN1C(=O)CCC(N2C(=O)c3csc(N=O)c3C2=O)C1=O

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 3/20 0.37
CRBN Q96SW2 3/20 0.37
POLB P06746 1/20 0.33
PPARG P37231 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
LMNA P02545 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL10054111 0.91 DDB1 (0.35) DDB1CRBN
SCHEMBL4776701 0.86 DDB1 (0.38) DDB1CRBNPOLBPPARGLMNA
SCHEMBL4777647 0.82 DDB1 (0.36) DDB1CRBNPPARGMEN1KMT2A
SCHEMBL4778654 0.82 DDB1 (0.38) DDB1CRBNPOLBPPARGKMT2A
SCHEMBL6816440 0.80 CRBN (0.35) DDB1CRBN
SCHEMBL4777868 0.77 DDB1 (0.36) DDB1CRBN
SCHEMBL4780071 0.76 PIN1 (0.41) PPARGMEN1KMT2ALMNAALDH1A1
SCHEMBL4780694 0.74 DDB1 (0.35) DDB1CRBNMEN1KMT2ALMNA
SCHEMBL4778940 0.71 PIN1 (0.47) PPARGMEN1KMT2ALMNAALDH1A1
SCHEMBL633625 0.71 ALDH1A1 (0.33) DDB1CRBNPOLBPPARGMEN1

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
US-20120220631-A1 USE OF 5H-THIOENO(3,4-c)PYRROLE-4,6-DIONE DERIVATIVES AS TUMOR NECROSIS FACTOR INHIBITOR TIANJIN HEMAY BIO-TECH CO., LTD. (CN) 2012-08-30 US disclosed
US-8183260-B2 small molecule, low toxicity, high efficiency, high economic value; 5-(2,6-dioxopiperidin-3-yl)-5H-thieno(3,4-c)pyrrole-4,6-dione: TIANJIN HEMAY BIO-TECH CO., LTD. (CN) 2012-05-22 US disclosed
US-20080176900-A1 5H-THIOENO(3,4-c)PYRROLE-4,6-DIONE DERIVATIVES AND THEIR USE AS TUMOR NECROSIS FACTOR INHIBITORS TIANJIN HEMAY BIO-TECH CO., LTD. (CN) 2008-07-24 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-20120220631-A1 USE OF 5H-THIOENO(3,4-c)PYRROLE-4,6-DIONE DERIVATIVES AS TUMOR NECROSIS FACTOR INHIBITOR TNF, TPMT, TNFRSF1A DDB1 790/4885CRBN 1305/4885POLB 878/4885
US-20080176900-A1 5H-THIOENO(3,4-c)PYRROLE-4,6-DIONE DERIVATIVES AND THEIR USE AS TUMOR NECROSIS FACTOR INHIBITORS TNF, TNFRSF1A, CD40 DDB1 1951/4885CRBN 938/4885POLB 2163/4885

“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.