SCHEMBL4408376

SCHEMBL4408376

O=C(Cl)c1nccc2ncccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
KDM4E B2RXH2 2/20 0.48
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
L3MBTL1 Q9Y468 3/20 0.43
PABPC1 P11940 3/20 0.43
EIF4H Q15056 3/20 0.43
ALDH1A1 P00352 4/20 0.43
LMNA P02545 3/20 0.43
HTT P42858 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ERN1 O75460 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
CYP3A4 P08684 3/20 0.40
BLM P54132 3/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
AGER Q15109 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSP90AA1 P07900 1/20 0.39

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
SCHEMBL360964 0.83 KDM4E (0.55) MAPTKDM4EMEN1KMT2AL3MBTL1
Hydrochloric Acid SCHEMBL4408378 0.81 KDM4E (0.53) MAPTKDM4EMEN1KMT2AL3MBTL1
SCHEMBL25391331 0.81 KDM4E (0.48) MAPTKDM4EMEN1KMT2AL3MBTL1
SCHEMBL22049082 0.77 L3MBTL1 (0.55) MAPTKDM4EMEN1KMT2AL3MBTL1
SCHEMBL927409 0.76 CNR2 (0.53) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL1133969 0.74 NSD2 (0.55) MAPTKDM4EMEN1KMT2AL3MBTL1
Hydrochloric Acid SCHEMBL9684991 0.74 CNR2 (0.51) MAPTMEN1KMT2AALDH1A1LMNA
Hydrochloric Acid SCHEMBL5450935 0.73 NSD2 (0.54) MAPTKDM4EMEN1KMT2AL3MBTL1
SCHEMBL1456330 0.72 TLR7 (0.51) MAPTKDM4EL3MBTL1ALDH1A1LMNA
SCHEMBL890368 0.72 KDM4E (0.55) MAPTKDM4EMEN1KMT2AL3MBTL1

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-20090181968-A1 Novel 3-Bicyclocarbonylaminopyridine-2-Carboxamides or 3-Bicyclocarbonylaminopyrazine-2-Carboxamides ASTRAZENECA AB (SE) 2009-07-16 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-20090181968-A1 Novel 3-Bicyclocarbonylaminopyridine-2-Carboxamides or 3-Bicyclocarbonylaminopyrazine-2-Carboxamides H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CCNA2, CNR2 MAPT 3167/4885KDM4E 1638/4885MEN1 1349/4885

“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.