SCHEMBL21630737

SCHEMBL21630737

[CH2]c1c(F)cccc1-c1cnn(CCC#N)c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 3/20 0.43
ATM Q13315 1/20 0.43
NTRK1 P04629 1/20 0.42
JAK2 O60674 9/20 0.42
TYK2 P29597 9/20 0.42
JAK1 P23458 5/20 0.42
STAT3 P40763 4/20 0.42
JAK3 P52333 4/20 0.42
RORC P51449 2/20 0.41
ABL1 P00519 1/20 0.37
MET P08581 1/20 0.36
PDK2 Q15119 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
SCHEMBL21630525 0.77 RORC (0.43) FEN1JAK2TYK2JAK1JAK3
SCHEMBL21630522 0.76 KCNH2 (0.55)
SCHEMBL21630642 0.76 CHRM1 (0.46) FEN1PDK2
SCHEMBL21630465 0.73 CREBBP (0.50) FEN1PDK2
SCHEMBL21630733 0.69 SCN9A (0.42) PDK2
SCHEMBL20399992 0.69 FEN1 (0.41) FEN1NTRK1JAK2TYK2JAK1
SCHEMBL21938097 0.68 CREBBP (0.59) JAK2TYK2JAK1STAT3JAK3
SCHEMBL16101552 0.68 JAK2 (0.46) FEN1NTRK1JAK2TYK2JAK1
SCHEMBL28706987 0.68 JAK2 (0.53) JAK2TYK2JAK1STAT3JAK3
SCHEMBL29425736 0.68 JAK2 (0.53) JAK2TYK2JAK1STAT3JAK3

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
US-11999740-B2 Fused pyrazine derivatives as A2A / A2B inhibitors INCYTE CORPORATION (US) 2024-06-04 US claimed
US-20220135570-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS INCYTE CORPORATION 2022-05-05 US claimed
CN-113166153-A Fused pyrazine derivatives as A2A/A2B inhibitors 因赛特公司 2021-07-23 CN claimed
US-20200031835-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS INCYTE CORPORATION 2020-01-30 US claimed
US-11999740-B2 Fused pyrazine derivatives as A2A / A2B inhibitors INCYTE CORPORATION (US) 2024-06-04 US disclosed
CN-117304191-A Fused pyrazine derivatives as A2A/A2B inhibitors 因赛特公司 2023-12-29 CN disclosed
US-20220135570-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS INCYTE CORPORATION 2022-05-05 US disclosed
US-11161850-B2 Fused pyrazine derivatives as A2A / A2B inhibitors INCYTE CORPORATION (US) 2021-11-02 US disclosed
CN-113166153-A Fused pyrazine derivatives as A2A/A2B inhibitors 因赛特公司 2021-07-23 CN disclosed
EP-3818063-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS Incyte Corporation (US) 2021-05-12 EP disclosed
US-20200031835-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS INCYTE CORPORATION 2020-01-30 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 (4 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-20220135570-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS ADORA2A, ADORA2B, ADORA1 FEN1 3139/4885ATM 1799/4885NTRK1 2168/4885
US-20200031835-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS ADORA2A, ADORA2B, ADORA1 FEN1 3139/4885ATM 1799/4885NTRK1 2168/4885
US-11161850-B2 Fused pyrazine derivatives as A2A / A2B inhibitors ADORA2A, ADORA2B, ADORA1 FEN1 3139/4885ATM 1799/4885NTRK1 2168/4885
US-11999740-B2 Fused pyrazine derivatives as A2A / A2B inhibitors ADORA2A, ADORA2B, ADORA1 FEN1 3139/4885ATM 1799/4885NTRK1 2168/4885

“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.