SCHEMBL30429293

SCHEMBL30429293

COc1ccncc1NC(=O)c1cc(-c2cccc(Cl)c2)ncn1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.58
KMO O15229 5/20 0.53
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
MAPK1 P28482 1/20 0.48
ABL1 P00519 1/20 0.48
BCR P11274 1/20 0.48
MAPT P10636 1/20 0.46
ATR Q13535 1/20 0.46
GSK3A P49840 1/20 0.44
NPC1 O15118 1/20 0.44
MET P08581 1/20 0.44
POLB P06746 1/20 0.43
GRM5 P41594 2/20 0.43
GRM4 Q14833 1/20 0.43
CLK1 P49759 1/20 0.42
DYRK1A Q13627 1/20 0.42
TGFBR1 P36897 1/20 0.42

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
SCHEMBL1937340 1.00 GSK3B (0.58) GSK3BKMOMEN1KMT2AMAPK1
SCHEMBL1938784 0.87 KMO (0.57) KMOMEN1KMT2AMAPTATR
SCHEMBL30429433 0.79 KMO (0.64) KMOMEN1KMT2AMAPTATR
SCHEMBL1938480 0.79 KMO (0.64) KMOMEN1KMT2AMAPTATR
SCHEMBL1938689 0.78 MAPT (0.64) KMOMEN1KMT2AMAPTPOLB
SCHEMBL30429075 0.78 KMO (0.60) KMOMEN1KMT2AMAPTPOLB
SCHEMBL1940169 0.78 KMO (0.60) KMOMEN1KMT2AMAPTPOLB
SCHEMBL1937379 0.78 KMO (0.54) KMOMEN1KMT2AMAPTGSK3A
SCHEMBL30428908 0.78 KMO (0.54) KMOMEN1KMT2AMAPTGSK3A
Hydrochloric Acid SCHEMBL1937303 0.78 MAPT (0.62) KMOMEN1KMT2AMAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12036292-B2 Heterobiaryl compounds and imaging agents for imaging huntingtin protein CHDI FOUNDATION, INC. (US) 2024-07-16 US disclosed
CN-116323583-A Heterobiaryl compounds and imaging agents for imaging huntingtin CHDI基金会股份有限公司 2023-06-23 CN disclosed
EP-4192819-A1 HETEROBIARYL COMPOUNDS AND IMAGING AGENTS FOR IMAGING HUNTINGTIN PROTEIN CHDI Foundation, Inc. (US) 2023-06-14 EP 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-12036292-B2 Heterobiaryl compounds and imaging agents for imaging huntingtin protein HTT, HYPK, ATXN2L GSK3B 1640/4885KMO 4249/4885MEN1 1693/4885

“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.