SCHEMBL2117148

SCHEMBL2117148

Cc1cc(NC(=O)Cc2cccs2)no1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 8/20 1.00
GAPDH P04406 5/20 1.00
ALOX15 P16050 4/20 1.00
ALDH1A1 P00352 4/20 1.00
KMT2A Q03164 4/20 1.00
HSD17B10 Q99714 3/20 1.00
MEN1 O00255 3/20 1.00
L3MBTL1 Q9Y468 2/20 1.00
MAPT P10636 1/20 1.00
HPGD P15428 1/20 1.00
APEX1 P27695 1/20 1.00
PTPN7 P35236 1/20 1.00
RECQL P46063 1/20 1.00
BLM P54132 1/20 1.00
BCL2L1 Q07817 1/20 1.00
MCL1 Q07820 1/20 1.00
PTK2B Q14289 1/20 1.00
TDP1 Q9NUW8 1/20 1.00
TP53 P04637 1/20 0.68
MAPK1 P28482 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
SCHEMBL8662613 0.78 POLB (0.72) POLBGAPDHALOX15ALDH1A1KMT2A
SCHEMBL1520029 0.77 KMT2A (1.00) POLBGAPDHALOX15ALDH1A1KMT2A
SCHEMBL4110225 0.74 ALDH1A1 (0.72) POLBGAPDHALOX15ALDH1A1KMT2A
SCHEMBL23867550 0.74 POLB (0.76) POLBALDH1A1KMT2AHSD17B10MEN1
SCHEMBL3416441 0.73 POLB (0.60) POLBGAPDHALOX15ALDH1A1KMT2A
SCHEMBL1302998 0.73 ALDH1A1 (0.66) POLBGAPDHALOX15ALDH1A1KMT2A
SCHEMBL145381 0.72 ALDH1A1 (0.70) POLBGAPDHALOX15ALDH1A1KMT2A
SCHEMBL4866373 0.72 ALDH1A1 (1.00) POLBGAPDHALOX15ALDH1A1KMT2A
SCHEMBL2639256 0.72 ALDH1A1 (0.70) POLBGAPDHALOX15ALDH1A1KMT2A
SCHEMBL2639258 0.72 ALDH1A1 (0.70) POLBGAPDHALOX15ALDH1A1KMT2A

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 6 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-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-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 (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-20090105240-A1 Methods for treating leukemia and myelodysplastic syndrome, and methods for identifying agents for treating same MCL1, AS3MT, MYADM POLB 819/4885GAPDH 281/4885ALOX15 1318/4885
US-20120095032-A1 METHODS FOR TREATING LEUKEMIA AND MYELODYSPLASTIC SYNDROME, AND METHODS FOR IDENTIFYING AGENTS FOR TREATING SAME MCL1, AS3MT, MYADM POLB 819/4885GAPDH 281/4885ALOX15 1318/4885

“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.