SCHEMBL22551965

SCHEMBL22551965

Cc1cnc2ccc(-c3nc(CN)c(N)nc3-c3ccc(F)c(F)c3)cn12

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 16/20 0.45
ADORA1 P30542 16/20 0.45
ADORA2B P29275 7/20 0.40
TGFBR1 P36897 3/20 0.40
TGFBR2 P37173 1/20 0.40
GRM2 Q14416 1/20 0.38

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
SCHEMBL30880733 0.89 ADORA2A (0.45) ADORA2AADORA1ADORA2BTGFBR1
SCHEMBL22579271 0.89 ADORA2A (0.45) ADORA2AADORA1ADORA2BTGFBR1
SCHEMBL22551897 0.89 ADORA2A (0.53) ADORA2AADORA1ADORA2BTGFBR1TGFBR2
SCHEMBL30880786 0.89 ADORA2A (0.53) ADORA2AADORA1ADORA2BTGFBR1TGFBR2
SCHEMBL22551808 0.87 ADORA2A (0.44) ADORA2AADORA1ADORA2BTGFBR1
SCHEMBL30880767 0.87 ADORA2A (0.44) ADORA2AADORA1ADORA2BTGFBR1
SCHEMBL23774592 0.85 ADORA2A (0.46) ADORA2AADORA1ADORA2BTGFBR1TGFBR2
SCHEMBL23774605 0.83 ADORA2A (0.39) ADORA2AADORA1ADORA2BTGFBR1
SCHEMBL22552059 0.82 TGFBR1 (0.45) ADORA2AADORA1ADORA2BTGFBR1TGFBR2
SCHEMBL30880837 0.82 TGFBR1 (0.45) ADORA2AADORA1ADORA2BTGFBR1TGFBR2

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 4 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-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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20230135068-A1 PYRAZINE COMPOUNDS AND USES THEREOF ADORA2A, ADORA2B, ADORA1 ADORA2A 1/4885ADORA1 3/4885ADORA2B 2/4885
US-20200330458-A1 PYRAZINE COMPOUNDS AND USES THEREOF ADORA2A, ADORA2B, ADORA1 ADORA2A 1/4885ADORA1 3/4885ADORA2B 2/4885

“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.