SCHEMBL23904131

SCHEMBL23904131

COc1ccc2nc3cc(Cl)ccc3c(NCCCCN)c2c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MBNL1 Q9NR56 1/20 0.77
ADORA2A P29274 1/20 0.73
MEN1 O00255 1/20 0.72
KMT2A Q03164 1/20 0.72
TDP1 Q9NUW8 1/20 0.72
GSR P00390 7/20 0.65
KDM4E B2RXH2 1/20 0.56
PHLPP2 Q6ZVD8 1/20 0.55
CYP19A1 P11511 1/20 0.55
NPC1 O15118 1/20 0.55
USP2 O75604 1/20 0.55
PRNP P04156 1/20 0.55
CHRM2 P08172 1/20 0.55
CHRM4 P08173 1/20 0.55
ABCB1 P08183 1/20 0.55
HTR1A P08908 1/20 0.55
CHRM5 P08912 1/20 0.55
ADRA2A P08913 1/20 0.55
CHRM1 P11229 1/20 0.55
ADRA2B P18089 1/20 0.55

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
SCHEMBL23904881 0.99 MBNL1 (0.76) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL23904666 0.99 MBNL1 (0.76) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL23795497 0.97 MBNL1 (0.75) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL7869225 0.94 MBNL1 (0.81) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL27739751 0.94 ADORA2A (0.74) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL3400316 0.93 MBNL1 (0.73) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL6895389 0.93 MBNL1 (0.67) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL20087027 0.93 MBNL1 (0.80) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL20087077 0.93 MBNL1 (0.80) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL20087053 0.93 MBNL1 (0.80) MBNL1ADORA2AMEN1KMT2ATDP1

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-20240287054-A1 COMPOUNDS THAT BIND NON-CANONICAL G-QUADRUPLEX STRUCTURES AND METHODS OF MAKING AND USING THE SAME THE U.S.A., AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2024-08-29 US disclosed
EP-4352054-A1 COMPOUNDS THAT BIND NON-CANONICAL G-QUADRUPLEX STRUCTURES AND METHODS OF MAKING AND USING THE SAME The United States of America, as represented by The Secretary, Department of Health and Human Services (US) 2024-04-17 EP disclosed
WO-2023225631-A1 INTERCALATING SUGAR MOLECULES XALUD THERAPEUTICS, INC. (US) 2023-11-23 WO disclosed
WO-2022261296-A1 COMPOUNDS THAT BIND NON-CANONICAL G-QUADRUPLEX STRUCTURES AND METHODS OF MAKING AND USING THE SAME THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2022-12-15 WO disclosed
WO-2022261296-A1 COMPOUNDS THAT BIND NON-CANONICAL G-QUADRUPLEX STRUCTURES AND METHODS OF MAKING AND USING THE SAME THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2022-12-15 WO disclosed
WO-2021202669-A2 NUCLEOSIDE AND NUCLEOTIDE CONJUGATE COMPOUNDS AND USES THEREOF REYOUNG CORPORATION (US) 2021-10-07 WO 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-20240287054-A1 COMPOUNDS THAT BIND NON-CANONICAL G-QUADRUPLEX STRUCTURES AND METHODS OF MAKING AND USING THE SAME MYC, MYCBP, TNS4 MBNL1 327/4885ADORA2A 3812/4885MEN1 365/4885

“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.