SCHEMBL2370142

SCHEMBL2370142

Cc1c(C(=O)O)c2ncccc2c(=O)n1NCCC(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALCA P06881 1/20 0.36
TLR8 Q9NR97 1/20 0.36
KDM4E B2RXH2 5/20 0.35
DTYMK P23919 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
KDM6B O15054 1/20 0.34
KDM6A O15550 1/20 0.34
TET3 O43151 1/20 0.34
KDM4A O75164 1/20 0.34
KDM4B O94953 1/20 0.34
KDM5C P41229 1/20 0.34
KDM4D Q6B0I6 1/20 0.34
TET2 Q6N021 1/20 0.34
ALKBH5 Q6P6C2 1/20 0.34
TET1 Q8NFU7 1/20 0.34
FTO Q9C0B1 1/20 0.34
EGLN1 Q9GZT9 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
KDM2A Q9Y2K7 1/20 0.34

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
SCHEMBL2453838 0.91 KDM4E (0.38) CALCATLR8KDM4EDTYMKSMN1; SMN2
SCHEMBL2453241 0.81 LATS1 (0.33) TLR8KDM6BKDM4CBRD4KAT2B
SCHEMBL14563442 0.81 KDM4E (0.40) KDM4ESMN1; SMN2L3MBTL1KDM6BKDM6A
SCHEMBL2370210 0.75 LATS1 (0.33) TLR8KDM6BKDM4CKAT2B
SCHEMBL2370137 0.73 KDM4E (0.39) KDM4EDTYMKSMN1; SMN2BRD4MAPT
SCHEMBL2833404 0.73 MEN1 (0.33) TLR8KAT2B
SCHEMBL2369636 0.67 KDM5A (0.39) KDM4ESMN1; SMN2POLB
SCHEMBL7415378 0.67 TLR8 (0.54) TLR8KDM4ESMN1; SMN2
SCHEMBL2832854 0.66 LMNA (0.40) KDM4EL3MBTL1POLB
SCHEMBL2453835 0.65 KDM4E (0.38) KDM4EDTYMKSMN1; SMN2BRD4KAT2B

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-20130190499-A1 Azaisoquinolinone derivatives as NK3 antagonists H. LUNDBECK A/S (DK) 2013-07-25 US disclosed
EP-2545053-A1 AZAISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS H. Lundbeck A/S (DK) 2013-01-16 EP disclosed
US-20110224247-A1 AZAISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS H. LUNDBECK A/S (DK) 2011-09-15 US disclosed
WO-2011110183-A1 AZAISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS H. LUNDBECK A/S (DK) 2011-09-15 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 (2 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-20110224247-A1 AZAISOQUINOLINONE DERIVATIVES AS NK3 ANTAGONISTS KCNQ3, KCNK3, KCND3 CALCA 4355/4885TLR8 1595/4885KDM4E 1390/4885
US-20130190499-A1 Azaisoquinolinone derivatives as NK3 antagonists KCNQ3, KCNK3, KCND3 CALCA 4355/4885TLR8 1595/4885KDM4E 1390/4885

“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.