SCHEMBL5717705

SCHEMBL5717705

NC(=O)Cc1csc(-c2ccccc2)n1

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.71
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
LMNA P02545 3/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
GAA P10253 3/20 0.57
ALDH1A1 P00352 3/20 0.56
HPGD P15428 2/20 0.55
RAB9A P51151 3/20 0.54
NPC1 O15118 1/20 0.54
HTT P42858 1/20 0.54
PRNP P04156 1/20 0.53
MAPT P10636 1/20 0.53

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
SCHEMBL5901574 0.87 KDM4E (0.55) KDM4EMEN1KMT2ALMNASMN1; SMN2
SCHEMBL1422234 0.87 LMNA (0.74) KDM4EMEN1KMT2ALMNASMN1; SMN2
SCHEMBL3455040 0.84 GFER (0.62) KDM4EMEN1KMT2ALMNASMN1; SMN2
SCHEMBL14087050 0.84 KDM4E (0.67) KDM4EMEN1KMT2ALMNASMN1; SMN2
SCHEMBL9832171 0.84 KDM4E (0.67) KDM4EMEN1KMT2ALMNASMN1; SMN2
SCHEMBL11156912 0.84 SHMT1 (0.62) KDM4EMEN1KMT2ALMNASMN1; SMN2
SCHEMBL5717700 0.81 KDM4E (0.78) KDM4EMEN1LMNASMN1; SMN2GAA
SCHEMBL18997274 0.80 KDM4E (0.66) KDM4EMEN1KMT2ALMNASMN1; SMN2
SCHEMBL19049510 0.80 KDM4E (0.62) KDM4EMEN1KMT2ALMNASMN1; SMN2
SCHEMBL12851276 0.80 KDM4E (0.74) KDM4EMEN1KMT2ALMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8772510-B2 PDE10 modulators HOFFMANN-LA ROCHE INC. (US) 2014-07-08 US claimed
US-20130059833-A1 PDE10 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2013-03-07 US claimed
CN-116262675-B Method for preparing malononitrile oxime ether compound 沈阳中化农药化工研发有限公司 2025-01-03 CN disclosed
US-11737463-B2 Pyridine and pyrazine compounds BASF SE (DE) 2023-08-29 US disclosed
CN-116262675-A Method for preparing malononitrile oxime ether compound 沈阳中化农药化工研发有限公司 2023-06-16 CN disclosed
US-20210145002-A1 PYRIDINE AND PYRAZINE COMPOUNDS BASF SE (DE) 2021-05-20 US disclosed
CN-103781768-B Pde10 regulator 霍夫曼-拉罗奇有限公司 2016-08-17 CN disclosed
EP-2753604-B1 PDE10 MODULATORS HOFFMANN LA ROCHE (CH) 2015-08-19 EP disclosed
US-8772510-B2 PDE10 modulators HOFFMANN-LA ROCHE INC. (US) 2014-07-08 US disclosed
EP-2574607-A1 PDE10 modulators F. Hoffmann-La Roche AG (CH) 2013-04-03 EP disclosed
WO-2013034506-A1 PDE10 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2013-03-14 WO disclosed
US-20130059833-A1 PDE10 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2013-03-07 US disclosed
EP-2295444-A2 Lipopeptides as antibacterial agents Cubist Pharmaceutical Inc. (US) 2011-03-16 EP disclosed
EP-1363925-B1 MACROLIDE ANTIBIOTICS GLAXO GROUP LTD (GB) 2006-11-15 EP disclosed
US-20060211636-A1 Macrolide Antibiotics ALIHODZIC SULEJMAN 2006-09-21 US disclosed
US-20050215495-A1 Macrolide antibiotics ALIHODZIC SULEJMAN 2005-09-29 US disclosed
US-20040077557-A1 Macrolide antibiotics GLAXO GROUP LIMITED (GB) 2004-04-22 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 (6 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-11737463-B2 Pyridine and pyrazine compounds NDUFS5, IL5, NDUFS4 KDM4E 1933/4885MEN1 1203/4885KMT2A 2890/4885
US-20210145002-A1 PYRIDINE AND PYRAZINE COMPOUNDS NDUFS5, IL5, NDUFS4 KDM4E 1933/4885MEN1 1203/4885KMT2A 2890/4885
US-20050215495-A1 Macrolide antibiotics IL1R1, MRPL12, RPS21 KDM4E 1204/4885MEN1 2872/4885KMT2A 2302/4885
US-20130059833-A1 PDE10 MODULATORS PDE10A, PDE5A, PDE2A KDM4E 1461/4885MEN1 2291/4885KMT2A 2193/4885
US-20060211636-A1 Macrolide Antibiotics IL1R1, MRPL12, RPS21 KDM4E 1204/4885MEN1 2872/4885KMT2A 2302/4885
US-20040077557-A1 Macrolide antibiotics MALT1, MRPL21, IL1R1 KDM4E 1358/4885MEN1 2870/4885KMT2A 2312/4885

“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.