SCHEMBL22895358

SCHEMBL22895358

c1nc(N[C@@H]2CCNC2)ncc1C1CC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 2/20 0.41
▸ KCNH2 Q12809 2/20 0.41
▸ MAPK3 P27361 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ AURKB Q96GD4 1/20 0.41
▸ CDK7 P50613 1/20 0.40
▸ CCNH P51946 1/20 0.40
▸ MNAT1 P51948 1/20 0.40
▸ BPTF Q12830 2/20 0.40
▸ MKNK1 Q9BUB5 1/20 0.40
▸ MKNK2 Q9HBH9 1/20 0.40
▸ IDH2 P48735 1/20 0.39

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
SCHEMBL28729081 1.00 SYK (0.41) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL31736623 0.89 IGF1R (0.46) MAPK1
Trifluoroacetic Acid SCHEMBL28549612 0.86 HRH4 (0.51) SYKKCNH2MAPK3MAPK1AURKB
Trifluoroacetic Acid SCHEMBL28549613 0.86 HRH4 (0.51) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL3631883 0.86 SYK (0.44) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL20577264 0.86 SYK (0.44) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL20577266 0.86 SYK (0.44) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL20576709 0.83 CCNK (0.46) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL17961848 0.83 CCNT1 (0.41) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL22895339 0.83 MAPK1 (0.56) MAPK1CDK7CCNHMNAT1BPTF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220388990-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES KINNATE BIOPHARMA INC. 2022-12-08 — — US disclosed
US-11358958-B2 — — 2022-06-14 — — US disclosed
EP-3999498-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES Kinnate Biopharma Inc. (US) 2022-05-25 — — EP disclosed
CN-114401955-A Inhibitors of cyclin dependent kinases 金耐特生物制药公司 2022-04-26 — — CN disclosed
US-20210130340-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES KINNATE BIOPHARMA INC. 2021-05-06 — — US disclosed
WO-2021011796-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES KINNATE BIOPHARMA INC. (US) 2021-01-21 — — WO disclosed
US-10894788-B2 Inhibitors of cyclin-dependent kinases KINNATE BIOPHARMA INC. (US) 2021-01-19 — — 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-11358958-B2 — CDK2, CDK1, CDK6 SYK 3504/4885KCNH2 4582/4885MAPK3 527/4885
US-20210130340-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES CDK2, CCNK, CDK1 SYK 2845/4885KCNH2 4484/4885MAPK3 379/4885
US-10894788-B2 Inhibitors of cyclin-dependent kinases CDK2, CCNK, CDK1 SYK 2845/4885KCNH2 4484/4885MAPK3 379/4885
US-20220388990-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES CDK2, CCNK, CDK1 SYK 2654/4885KCNH2 4416/4885MAPK3 369/4885

“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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