SCHEMBL31492743

SCHEMBL31492743

O=C(O)C1Nc2ccccc2C2C=CCC12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 15/20 1.00
HSPA1A P0DMV8 13/20 1.00
TDP1 Q9NUW8 5/20 1.00
GAPDH P04406 8/20 0.71
POLB P06746 5/20 0.71
KMT2A Q03164 5/20 0.71
MEN1 O00255 4/20 0.71
BLM P54132 4/20 0.71
PLA2G1B P04054 1/20 0.71
MIF P14174 1/20 0.71
ATG4B Q9Y4P1 1/20 0.71
L3MBTL1 Q9Y468 4/20 0.67
CDC25B P30305 3/20 0.67
KDM4E B2RXH2 3/20 0.67
MAPT P10636 3/20 0.67
RECQL P46063 3/20 0.67
HSD17B10 Q99714 3/20 0.67
ALDH1A1 P00352 3/20 0.67
MASP2 O00187 3/20 0.67
CD44 P16070 3/20 0.67

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
SCHEMBL26098723 1.00 PTPN7 (1.00) PTPN7HSPA1ATDP1GAPDHPOLB
SCHEMBL16706087 0.83 PTPN7 (1.00) PTPN7HSPA1ATDP1GAPDHPOLB
SCHEMBL29415450 0.81 PTPN7 (1.00) PTPN7HSPA1ATDP1GAPDHPOLB
SCHEMBL3610631 0.81 CDC25B (1.00) PTPN7HSPA1ATDP1GAPDHPOLB
SCHEMBL2116528 0.81 PTPN7 (1.00) PTPN7HSPA1ATDP1GAPDHPOLB
SCHEMBL2808722 0.81 PTPN7 (1.00) PTPN7HSPA1ATDP1GAPDHPOLB
SCHEMBL13186581 0.81 PTPN7 (0.73) PTPN7HSPA1ATDP1GAPDHPOLB
SCHEMBL6678349 0.79 PTPN7 (0.65) PTPN7HSPA1ATDP1GAPDHPOLB
SCHEMBL2116061 0.79 PTPN7 (1.00) PTPN7HSPA1ATDP1GAPDHPOLB
SCHEMBL29954899 0.79 POLB (1.00) PTPN7HSPA1ATDP1GAPDHPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250090566-A1 BACTERIAL DNA GYRASE INHIBITORS AND METHODS OF USE THEREOF THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES (US) 2025-03-20 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-20250090566-A1 BACTERIAL DNA GYRASE INHIBITORS AND METHODS OF USE THEREOF TOP1, DNA2, TOP2A PTPN7 4543/4885HSPA1A 1352/4885TDP1 63/4885

“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.