SCHEMBL13856682

SCHEMBL13856682

O=C(Nc1ccc2nc(-c3ccco3)c(-c3ccco3)nc2c1)N1CCCCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 8/20 1.00
TDP1 Q9NUW8 4/20 1.00
HPGD P15428 4/20 1.00
MEN1 O00255 3/20 1.00
POLB P06746 3/20 1.00
BLM P54132 3/20 1.00
KMT2A Q03164 3/20 1.00
L3MBTL1 Q9Y468 3/20 1.00
KDM4E B2RXH2 3/20 1.00
ALDH1A1 P00352 3/20 1.00
KDM4D Q6B0I6 2/20 1.00
MAPT P10636 2/20 1.00
THRB P10828 2/20 1.00
ALOX15 P16050 2/20 1.00
MAPK1 P28482 2/20 1.00
CASP1 P29466 2/20 1.00
BRCA1 P38398 2/20 1.00
RECQL P46063 2/20 1.00
CASP7 P55210 2/20 1.00
HSD17B10 Q99714 2/20 1.00

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
SCHEMBL9613308 0.99 TDP1 (1.00) PTPN7TDP1HPGDMEN1POLB
SCHEMBL9613368 0.90 PTPN7 (1.00) PTPN7TDP1HPGDMEN1POLB
SCHEMBL5992705 0.86 KDM4D (1.00) PTPN7TDP1HPGDMEN1POLB
SCHEMBL5997551 0.85 KDM4D (0.98) PTPN7TDP1HPGDMEN1POLB
SCHEMBL9613352 0.82 PTPN7 (0.73) PTPN7TDP1HPGDMEN1POLB
SCHEMBL2116513 0.81 PTPN7 (1.00) PTPN7TDP1HPGDMEN1POLB
SCHEMBL9613309 0.80 TDP1 (0.67) PTPN7TDP1HPGDMEN1POLB
SCHEMBL9613359 0.79 PTPN7 (0.77) PTPN7TDP1HPGDMEN1POLB
SCHEMBL9613331 0.78 KDM4E (1.00) PTPN7TDP1HPGDMEN1POLB
SCHEMBL6238251 0.77 PTPN7 (1.00) PTPN7TDP1HPGDMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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-20090118135-A1 METHODS AND COMPOUNDS FOR REGULATING APOPTOSIS BCL2, BAX, BAD PTPN7 3199/4885TDP1 2043/4885HPGD 2147/4885

“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.