SCHEMBL3418239

SCHEMBL3418239

CCCCCc1nnc(NC(=O)Cc2cccs2)s1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 9/20 1.00
L3MBTL1 Q9Y468 4/20 1.00
MEN1 O00255 4/20 1.00
KMT2A Q03164 4/20 1.00
TDP1 Q9NUW8 3/20 1.00
CTDSP1 Q9GZU7 3/20 1.00
HSD17B10 Q99714 3/20 1.00
PTPN7 P35236 3/20 1.00
APEX1 P27695 2/20 1.00
ALOX15 P16050 2/20 1.00
GAPDH P04406 2/20 1.00
NR4A1 P22736 1/20 1.00
BLM P54132 1/20 1.00
GLS O94925 6/20 0.88
F2 P00734 1/20 0.70
ALDH1A1 P00352 3/20 0.68
RECQL P46063 2/20 0.68
LMNA P02545 2/20 0.68
PSMD14 O00487 1/20 0.68
MAPT P10636 1/20 0.68

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
SCHEMBL14986950 0.94 GLS (1.00) POLBL3MBTL1MEN1KMT2ATDP1
SCHEMBL16306830 0.92 GLS (0.95) POLBL3MBTL1MEN1KMT2ATDP1
SCHEMBL14987287 0.83 GLS (1.00) POLBL3MBTL1MEN1KMT2ATDP1
SCHEMBL15043807 0.81 GLS (1.00) POLBL3MBTL1MEN1KMT2ATDP1
SCHEMBL21368571 0.80 GLS (0.77) POLBL3MBTL1MEN1KMT2ATDP1
SCHEMBL2116109 0.79 GLS (0.88) POLBL3MBTL1MEN1KMT2ATDP1
SCHEMBL14987500 0.79 GLS (1.00) GLS
SCHEMBL14987507 0.79 GLS (1.00) GLS
SCHEMBL15724977 0.78 GLS (0.70) POLBL3MBTL1MEN1KMT2ATDP1
SCHEMBL17172556 0.78 GLS (0.70) POLBL3MBTL1MEN1KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105240-A1 Methods for treating leukemia and myelodysplastic syndrome, and methods for identifying agents for treating same SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE 2009-04-23 US claimed
US-20120095032-A1 METHODS FOR TREATING LEUKEMIA AND MYELODYSPLASTIC SYNDROME, AND METHODS FOR IDENTIFYING AGENTS FOR TREATING SAME SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE 2012-04-19 US disclosed
US-20120095032-A1 METHODS FOR TREATING LEUKEMIA AND MYELODYSPLASTIC SYNDROME, AND METHODS FOR IDENTIFYING AGENTS FOR TREATING SAME SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE 2012-04-19 US disclosed
US-20090118135-A1 METHODS AND COMPOUNDS FOR REGULATING APOPTOSIS THE BURNHAM INSTITUTE (US) 2009-05-07 US disclosed
US-20090118135-A1 METHODS AND COMPOUNDS FOR REGULATING APOPTOSIS THE BURNHAM INSTITUTE (US) 2009-05-07 US disclosed
US-20090105240-A1 Methods for treating leukemia and myelodysplastic syndrome, and methods for identifying agents for treating same SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE 2009-04-23 US disclosed
US-20090105240-A1 Methods for treating leukemia and myelodysplastic syndrome, and methods for identifying agents for treating same SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE 2009-04-23 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 (3 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-20090105240-A1 Methods for treating leukemia and myelodysplastic syndrome, and methods for identifying agents for treating same MCL1, AS3MT, MYADM POLB 819/4885L3MBTL1 1464/4885MEN1 1901/4885
US-20090118135-A1 METHODS AND COMPOUNDS FOR REGULATING APOPTOSIS BCL2, BAX, BAD POLB 1539/4885L3MBTL1 141/4885MEN1 4323/4885
US-20120095032-A1 METHODS FOR TREATING LEUKEMIA AND MYELODYSPLASTIC SYNDROME, AND METHODS FOR IDENTIFYING AGENTS FOR TREATING SAME MCL1, AS3MT, MYADM POLB 819/4885L3MBTL1 1464/4885MEN1 1901/4885

“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.