SCHEMBL23859614

SCHEMBL23859614

CC1CN(c2c(-c3ccc(F)cc3)nc(N)n3c(=O)n(CCC(F)(F)F)nc23)CC(C)O1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 7/20 0.36
▸ ADORA2B P29275 5/20 0.36
▸ GAK O14976 1/20 0.33
▸ ADORA1 P30542 5/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ CSNK1D P48730 2/20 0.32
▸ CSNK1E P49674 2/20 0.32
▸ KDM1A O60341 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ ADORA3 P0DMS8 1/20 0.31
▸ GRM2 Q14416 1/20 0.31
▸ METAP2 P50579 2/20 0.31
▸ PLK1 P53350 2/20 0.31
▸ PLK2 Q9NYY3 2/20 0.31

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
SCHEMBL23859611 1.00 ADORA2A (0.36) ADORA2AADORA2BGAKADORA1ALDH1A1
SCHEMBL23859569 0.92 ADORA2A (0.41) ADORA2AADORA1ALDH1A1SMN1; SMN2
SCHEMBL23859566 0.92 ADORA2A (0.41) ADORA2AADORA1ALDH1A1SMN1; SMN2
SCHEMBL23859583 0.90 GAK (0.35) ADORA2AADORA2BGAKADORA1ALDH1A1
SCHEMBL23859585 0.90 GAK (0.35) ADORA2AADORA2BGAKADORA1ALDH1A1
SCHEMBL25176009 0.81 ADORA2A (0.43) ADORA2AADORA1ALDH1A1SMN1; SMN2
SCHEMBL23874234 0.81 ADORA2A (0.43) ADORA2AADORA1ALDH1A1SMN1; SMN2
SCHEMBL23859469 0.80 ADORA2A (0.41) ADORA2AADORA1ALDH1A1SMN1; SMN2
SCHEMBL23859468 0.80 ADORA2A (0.41) ADORA2AADORA1ALDH1A1SMN1; SMN2
SCHEMBL23876612 0.79 ADORA2A (0.45) ADORA2AADORA2BADORA1ALDH1A1SMN1; SMN2

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
EP-4126871-B1 TRIAZOLONE COMPOUNDS HEPTARES THERAPEUTICS LTD (GB) 2024-05-08 — — EP claimed
US-20230146796-A1 TRIAZOLONE COMPOUNDS ASTRAZENECA AB (SE) 2023-05-11 — — US claimed
US-12552799-B2 Triazolone compounds NXERA PHARMA UK LIMITED (GB) 2026-02-17 — — US disclosed
EP-4126871-B1 TRIAZOLONE COMPOUNDS HEPTARES THERAPEUTICS LTD (GB) 2024-05-08 — — EP disclosed
US-20230146796-A1 TRIAZOLONE COMPOUNDS ASTRAZENECA AB (SE) 2023-05-11 — — US disclosed
EP-4126871-A1 TRIAZOLONE COMPOUNDS Heptares Therapeutics Limited (GB) 2023-02-08 — — EP disclosed
WO-2021191380-A1 TRIAZOLONE COMPOUNDS ASTRAZENECA AB (SE) 2021-09-30 — — 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 (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-20230146796-A1 TRIAZOLONE COMPOUNDS ADORA2A, ADORA1, ADORA3 ADORA2A 1/4885ADORA2B 4/4885GAK 578/4885
US-12552799-B2 Triazolone compounds ADORA1, ADRA2C, ADORA2A ADORA2A 3/4885ADORA2B 8/4885GAK 1147/4885

“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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