SCHEMBL21730306

SCHEMBL21730306

Nc1nc(-c2ccc(F)cc2)c(Cl)nc1CNC(=O)c1ccccn1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ ADORA2A P29274 4/20 0.48
▸ ADORA1 P30542 4/20 0.48
▸ TLR7 Q9NYK1 1/20 0.47
▸ TSHR P16473 1/20 0.44
▸ HTT P42858 1/20 0.43
▸ PTGS1 P23219 1/20 0.43
▸ PTGS2 P35354 1/20 0.43
▸ SCN9A Q15858 1/20 0.43
▸ MAPK14 Q16539 1/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ GRIN2B Q13224 1/20 0.42
▸ MAOB P27338 1/20 0.42
▸ HDAC3 O15379 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ ADORA2B P29275 1/20 0.42

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
SCHEMBL30880783 1.00 KMT2A (0.51) KMT2AMEN1ADORA2AADORA1TLR7
SCHEMBL21730308 0.85 ADORA2A (0.55) KMT2AMEN1ADORA2AADORA1TLR7
SCHEMBL29907717 0.85 ADORA2A (0.55) KMT2AMEN1ADORA2AADORA1TLR7
SCHEMBL22551908 0.81 ADORA2A (0.48) KMT2AADORA2AADORA1ADORA2B
SCHEMBL30880775 0.81 ADORA2A (0.48) KMT2AADORA2AADORA1ADORA2B
SCHEMBL22551993 0.78 ADORA2A (0.57) KMT2AADORA2AADORA1ADORA2B
SCHEMBL30880823 0.78 ADORA2A (0.57) KMT2AADORA2AADORA1ADORA2B
SCHEMBL29907746 0.76 ADORA2A (0.57) ADORA2AADORA1ADORA2B
SCHEMBL22552016 0.76 ADORA2A (0.57) ADORA2AADORA1ADORA2B
SCHEMBL27877038 0.74 KMT2A (0.68) KMT2AMEN1HTTPTGS1PTGS2

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 11 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-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-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-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
US-20200330458-A1 PYRAZINE COMPOUNDS AND USES THEREOF DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2020-10-22 — — US disclosed
WO-2020035052-A1 PYRAZINE COMPOUNDS AND USES THEREOF DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2020-02-20 — — 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 (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 KMT2A 3330/4885MEN1 2917/4885ADORA2A 1/4885
US-20230135068-A1 PYRAZINE COMPOUNDS AND USES THEREOF ADORA2A, ADORA2B, ADORA1 KMT2A 3330/4885MEN1 2917/4885ADORA2A 1/4885
US-11571420-B2 Pyrazine compounds and uses thereof ADORA2A, ADORA2B, ADORA1 KMT2A 3330/4885MEN1 2917/4885ADORA2A 1/4885
US-20200330458-A1 PYRAZINE COMPOUNDS AND USES THEREOF ADORA2A, ADORA2B, ADORA1 KMT2A 3330/4885MEN1 2917/4885ADORA2A 1/4885
US-20210251989-A1 PYRAZINE COMPOUNDS AND USES THEREOF ADORA2A, ADORA2B, ADORA1 KMT2A 3330/4885MEN1 2917/4885ADORA2A 1/4885

“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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