SCHEMBL22551940

SCHEMBL22551940

Cc1cc(-c2nc(CNC(=O)OC(C)(C)C)c(N)nc2Cl)co1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPKAPK2 P49137 9/20 0.42
▸ KDM4A O75164 1/20 0.35
▸ ATR Q13535 1/20 0.35
▸ TRPV1 Q8NER1 1/20 0.33
▸ GRM2 Q14416 1/20 0.33
▸ PRMT5 O14744 1/20 0.33
▸ WDR77 Q9BQA1 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CACNA1H O95180 1/20 0.33
▸ CACNA1B Q00975 1/20 0.33
▸ CACNA1C Q13936 1/20 0.33
▸ IDO1 P14902 1/20 0.33
▸ STK17B O94768 1/20 0.33
▸ STK17A Q9UEE5 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
SCHEMBL22551859 0.81 ADORA2A (0.50) MAPKAPK2ATR
SCHEMBL22579093 0.76 MAPKAPK2 (0.48) MAPKAPK2ATR
SCHEMBL21722462 0.67 ADORA2A (0.55) ATR
SCHEMBL11927607 0.66 MAPKAPK2 (0.57) MAPKAPK2
SCHEMBL16532758 0.65 GAA (0.48) KDM4AGRM2CACNA1HCACNA1BCACNA1C
SCHEMBL6468245 0.64 KDM4A (0.42) MAPKAPK2KDM4ACYP1A2CACNA1HCACNA1B
SCHEMBL122455 0.64 GAA (0.42) KDM4AIDO1STK17BSTK17A
SCHEMBL24423243 0.64 STK17B (0.50) MAPKAPK2KDM4AATRIDO1STK17B
SCHEMBL2004242 0.64 TSHR (0.44) KDM4AGRM2IDO1
SCHEMBL19782553 0.64 ATR (0.47) MAPKAPK2KDM4AATRSTK17BSTK17A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115181092-B Pyrazine compounds and uses thereof 迪哲(江苏)医药股份有限公司 2024-05-03 — — CN disclosed
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 MAPKAPK2 1351/4885KDM4A 4319/4885ATR 2808/4885
US-20230135068-A1 PYRAZINE COMPOUNDS AND USES THEREOF ADORA2A, ADORA2B, ADORA1 MAPKAPK2 1351/4885KDM4A 4319/4885ATR 2808/4885
US-11571420-B2 Pyrazine compounds and uses thereof ADORA2A, ADORA2B, ADORA1 MAPKAPK2 1351/4885KDM4A 4319/4885ATR 2808/4885
US-20200330458-A1 PYRAZINE COMPOUNDS AND USES THEREOF ADORA2A, ADORA2B, ADORA1 MAPKAPK2 1351/4885KDM4A 4319/4885ATR 2808/4885
US-20210251989-A1 PYRAZINE COMPOUNDS AND USES THEREOF ADORA2A, ADORA2B, ADORA1 MAPKAPK2 1351/4885KDM4A 4319/4885ATR 2808/4885

“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.

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