SCHEMBL20600782

SCHEMBL20600782

Nc1nc(-c2cc(F)c3ncccc3c2)c(Br)nc1Br

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 10/20 0.47
▸ ADORA3 P0DMS8 2/20 0.47
▸ ADORA1 P30542 2/20 0.47
▸ PDE4D Q08499 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ PLK4 O00444 1/20 0.34
▸ MAP4K4 O95819 1/20 0.34
▸ EGFR P00533 1/20 0.34
▸ ROS1 P08922 1/20 0.34
▸ PIM1 P11309 1/20 0.34
▸ AXL P30530 1/20 0.34
▸ FLT3 P36888 1/20 0.34
▸ FRK P42685 1/20 0.34
▸ MAP4K2 Q12851 1/20 0.34
▸ NTRK3 Q16288 1/20 0.34
▸ MINK1 Q8N4C8 1/20 0.34
▸ AURKB Q96GD4 1/20 0.34

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
SCHEMBL22230334 0.76 ADORA2A (0.50) ADORA2AADORA3ADORA1L3MBTL1
SCHEMBL20666051 0.75 ADORA2A (0.52) ADORA2AADORA3ADORA1KDM4ENPC1
SCHEMBL24619110 0.75 ADORA2A (0.46) ADORA2AADORA3ADORA1KDM4ENPC1
SCHEMBL29727041 0.75 ADORA2A (0.46) ADORA2AADORA3ADORA1KDM4ENPC1
SCHEMBL20666042 0.74 ADORA2A (0.43) ADORA2AADORA3ADORA1KDM4ENPC1
SCHEMBL20666230 0.73 ADORA2A (0.55) ADORA2AADORA3ADORA1
SCHEMBL20667492 0.73 ADORA2A (0.57) ADORA2AADORA3ADORA1PDE4D
SCHEMBL22271103 0.72 ADORA2A (0.51) ADORA2AADORA3ADORA1KDM4ETOP1
SCHEMBL20667533 0.72 ADORA2A (0.58) ADORA2AADORA3ADORA1KDM4E
SCHEMBL20600822 0.71 FEN1 (0.45) ADORA2AADORA3ADORA1PDE4DKDM4E

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
US-20200369665-A1 IMIDAZO[1,2-A]PYRAZINE MODULATORS OF THE ADENOSINE A2A RECEPTOR Ryvu Therapeutics S.A. (PL) 2020-11-26 — — US disclosed
US-20200369665-A1 IMIDAZO[1,2-A]PYRAZINE MODULATORS OF THE ADENOSINE A2A RECEPTOR Ryvu Therapeutics S.A. (PL) 2020-11-26 — — US disclosed
EP-3645536-A1 IMIDAZO[1,2-A]PYRAZINE MODULATORS OF THE ADENOSINE A2A RECEPTOR Ryvu Therapeutics S.A. (PL) 2020-05-06 — — EP disclosed
CN-110809577-A Modulators of adenosine A2A receptor 雷沃医疗有限公司 2020-02-18 — — CN disclosed
WO-2019002606-A1 IMIDAZO[1,2-A]PYRAZINE MODULATORS OF THE ADENOSINE A2A RECEPTOR SELVITA S.A. (PL) 2019-01-03 — — WO disclosed
WO-2019002606-A1 IMIDAZO[1,2-A]PYRAZINE MODULATORS OF THE ADENOSINE A2A RECEPTOR SELVITA S.A. (PL) 2019-01-03 — — 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-20200369665-A1 IMIDAZO[1,2-A]PYRAZINE MODULATORS OF THE ADENOSINE A2A RECEPTOR ADORA2A, ADORA1, ADORA3 ADORA2A 1/4885ADORA3 3/4885ADORA1 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.

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