SCHEMBL22551906

SCHEMBL22551906

CN(CCOc1cccnc1C#N)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
KDM4E B2RXH2 6/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PLCG1 P19174 1/20 0.41
MMP2 P08253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 1/20 0.38
RBP4 P02753 1/20 0.36

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
SCHEMBL30880760 0.84 PLCG1 (0.43) ALDH1A1KDM4ESMN1; SMN2PLCG1MMP2
SCHEMBL22551922 0.84 PLCG1 (0.43) ALDH1A1KDM4ESMN1; SMN2PLCG1MMP2
SCHEMBL22552118 0.83 HTR7 (0.49) ALDH1A1KDM4ESMN1; SMN2
SCHEMBL3470698 0.80 SMN1; SMN2 (0.49) ALDH1A1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL4282591 0.76 L3MBTL1 (0.47) ALDH1A1KDM4ESMN1; SMN2PLCG1L3MBTL1
SCHEMBL22366589 0.75 SLC22A12 (0.38) ALDH1A1MMP2
SCHEMBL22552075 0.75 PDE5A (0.43) ALDH1A1KDM4EPLCG1
SCHEMBL19384152 0.75 KDM4E (0.49) ALDH1A1KDM4ESMN1; SMN2L3MBTL1LMNA
SCHEMBL22551784 0.74 USP8 (0.43) ALDH1A1KDM4ESMN1; SMN2PLCG1LMNA
SCHEMBL11498598 0.73 PDE5A (0.45) ALDH1A1KDM4EPLCG1L3MBTL1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230135068-A1 PYRAZINE COMPOUNDS AND USES THEREOF DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2023-05-04 US disclosed
US-11571420-B2 Pyrazine compounds and uses thereof DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2023-02-07 US disclosed
US-20210251989-A1 PYRAZINE COMPOUNDS AND USES THEREOF DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2021-08-19 US disclosed
US-10898481-B2 Pyrazine compounds and uses thereof DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2021-01-26 US disclosed
US-20200330458-A1 PYRAZINE COMPOUNDS AND USES THEREOF DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2020-10-22 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 (5 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-10898481-B2 Pyrazine compounds and uses thereof ADORA2A, ADORA2B, ADORA1 ALDH1A1 1105/4885KDM4E 4220/4885SMN1; SMN2 4427/4885
US-20230135068-A1 PYRAZINE COMPOUNDS AND USES THEREOF ADORA2A, ADORA2B, ADORA1 ALDH1A1 1105/4885KDM4E 4220/4885SMN1; SMN2 4427/4885
US-11571420-B2 Pyrazine compounds and uses thereof ADORA2A, ADORA2B, ADORA1 ALDH1A1 1105/4885KDM4E 4220/4885SMN1; SMN2 4427/4885
US-20200330458-A1 PYRAZINE COMPOUNDS AND USES THEREOF ADORA2A, ADORA2B, ADORA1 ALDH1A1 1105/4885KDM4E 4220/4885SMN1; SMN2 4427/4885
US-20210251989-A1 PYRAZINE COMPOUNDS AND USES THEREOF ADORA2A, ADORA2B, ADORA1 ALDH1A1 1105/4885KDM4E 4220/4885SMN1; SMN2 4427/4885

“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.