SCHEMBL8660096

SCHEMBL8660096

O=C1OC(=O)c2ncc(Cl)cc21

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 13/20 0.35
PTGS1 P23219 7/20 0.35
PDK2 Q15119 1/20 0.35
ALOX15 P16050 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ABCC4 O15439 1/20 0.34
ABCB11 O95342 1/20 0.34
PDE4D Q08499 1/20 0.34
MAPK14 Q16539 1/20 0.34
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
PABPC1 P11940 1/20 0.33
KMT2A Q03164 1/20 0.33
TYMS P04818 1/20 0.32

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
SCHEMBL2333513 0.76 KMT2A (0.53) PTGS2PTGS1PDK2ALOX15TDP1
SCHEMBL30718118 0.76 KMT2A (0.53) PTGS2PTGS1PDK2ALOX15TDP1
SCHEMBL4068805 0.76 ALOX15 (0.34) ALOX15TDP1KMT2A
SCHEMBL4073817 0.76 DYRK1A (0.35) ALOX15TDP1HTTHSD17B10KMT2A
SCHEMBL2333074 0.76 ALOX15 (0.31) ALOX15TDP1
SCHEMBL2514710 0.76 ALOX15 (0.31) ALOX15TDP1
SCHEMBL29541279 0.73 ALOX15 (0.32) ALOX15TDP1KMT2A
SCHEMBL7547799 0.72 NPC1 (0.37) PTGS2ALOX15TDP1LMNAKMT2A
SCHEMBL9461473 0.72 MAP4K4 (0.42) ALOX15TDP1HTTMEN1LMNA
SCHEMBL13993888 0.72 PDK2 (0.40) PDK2TDP1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240190874-A1 SMALL MOLECULE DEGRADERS OF ANDROGEN RECEPTOR THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2024-06-13 US disclosed
WO-2022187419-A1 SMALL MOLECULE DEGRADERS OF ANDROGEN RECEPTOR THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2022-09-09 WO disclosed
US-5840904-A Fluoro-pyridine-2,3-dicarboxylic anhydrides which are intermediates for herbicidal pyridine-2,3-dicarboximides BASF AKTIENGESELLSCHAFT (DE) 1998-11-24 US disclosed
US-5679622-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1997-10-21 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-20240190874-A1 SMALL MOLECULE DEGRADERS OF ANDROGEN RECEPTOR AR, CYP19A1, ESRRA PTGS2 3290/4885PTGS1 2002/4885PDK2 2447/4885

“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.