SCHEMBL2895832

SCHEMBL2895832

CSc1cncc(Cl)c1C#N

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.36
MEN1 O00255 6/20 0.36
HTT P42858 2/20 0.36
GLA P06280 1/20 0.36
TSHR P16473 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
KDM4E B2RXH2 8/20 0.35
ALDH1A1 P00352 7/20 0.35
HPGD P15428 4/20 0.35
MAPT P10636 3/20 0.35
NPSR1 Q6W5P4 3/20 0.35
RXFP1 Q9HBX9 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GALR3 O60755 1/20 0.35
HIF1A Q16665 1/20 0.35
LMNA P02545 3/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL193133 0.79 ALDH1A1 (0.39) KMT2AMEN1HTTCYP11B1CYP11B2
SCHEMBL2926664 0.78 ALDH1A1 (0.40) KMT2AMEN1HTTTSHRKDM4E
SCHEMBL10260750 0.74 KDM4E (0.35) KMT2AMEN1HTTGLATSHR
SCHEMBL8494974 0.71 KDM4E (0.43) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL7959800 0.69 GAA (0.40) KMT2AMEN1HTTTSHRCYP11B2
SCHEMBL21883721 0.69 GAA (0.35) GAA
SCHEMBL28862859 0.69 IDO1 (0.31)
SCHEMBL30937756 0.69 GAA (0.40) KMT2AMEN1HTTTSHRCYP11B2
SCHEMBL13058556 0.69 HTT (0.33) HTTCYP11B2MAPT
SCHEMBL5803123 0.69 ALDH1A1 (0.38) KMT2AMEN1HTTTSHRCYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8440666-B2 Pyridazinone compounds and P2X7 receptor inhibitors NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2013-05-14 US disclosed
US-8440666-B2 Pyridazinone compounds and P2X7 receptor inhibitors NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2013-05-14 US disclosed
US-8440666-B2 Pyridazinone compounds and P2X7 receptor inhibitors NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2013-05-14 US disclosed
US-20100286390-A1 PYRIDAZINONE COMPOUNDS AND P2X7 RECEPTOR INHIBITORS NISSAN CHEMICAL INDUSTRIES LIMITED 2010-11-11 US disclosed
US-20100286390-A1 PYRIDAZINONE COMPOUNDS AND P2X7 RECEPTOR INHIBITORS NISSAN CHEMICAL INDUSTRIES LIMITED 2010-11-11 US disclosed
US-20100286390-A1 PYRIDAZINONE COMPOUNDS AND P2X7 RECEPTOR INHIBITORS NISSAN CHEMICAL INDUSTRIES LIMITED 2010-11-11 US disclosed
WO-2009057827-A1 PYRIDAZINONE DERIVATIVES AND USE THEREOF AS P2X7 RECEPTOR INHIBITORS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-05-07 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 (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-20100286390-A1 PYRIDAZINONE COMPOUNDS AND P2X7 RECEPTOR INHIBITORS P2RY1, P2RX7, P2RX1 KMT2A 4583/4885MEN1 3931/4885HTT 4503/4885

“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.