SCHEMBL25361247

SCHEMBL25361247

COc1ccc(CSc2nc(N)c(C#N)c(-c3ccc(OCCO)cc3)c2C#N)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA1 P30542 16/20 0.72
▸ RET P07949 1/20 0.69
▸ SLC6A3 Q01959 1/20 0.65
▸ ADORA3 P0DMS8 1/20 0.64
▸ ADORA2A P29274 1/20 0.64
▸ ADORA2B P29275 1/20 0.64
▸ KDM4E B2RXH2 3/20 0.62
▸ ALDH1A1 P00352 3/20 0.62
▸ MAPT P10636 3/20 0.62
▸ MEN1 O00255 2/20 0.62
▸ KMT2A Q03164 2/20 0.62
▸ NPSR1 Q6W5P4 2/20 0.62
▸ GAA P10253 1/20 0.62
▸ RXFP1 Q9HBX9 1/20 0.60
▸ USP2 O75604 1/20 0.60
▸ TP53 P04637 1/20 0.60
▸ HPGD P15428 1/20 0.60
▸ ALOX15 P16050 1/20 0.60
▸ HSD17B10 Q99714 1/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.60

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
SCHEMBL25359172 0.90 ADORA1 (0.58) ADORA1RETSLC6A3ADORA3ADORA2A
SCHEMBL8031838 0.90 ADORA1 (0.61) ADORA1RETSLC6A3ADORA3ADORA2A
SCHEMBL26010414 0.89 ADORA1 (0.66) ADORA1SLC6A3ADORA3ADORA2AADORA2B
SCHEMBL26010416 0.87 ADORA1 (0.66) ADORA1SLC6A3ADORA3ADORA2AADORA2B
SCHEMBL13913748 0.86 ADORA1 (0.74) ADORA1RETADORA3ADORA2AADORA2B
SCHEMBL13914654 0.85 RET (0.70) ADORA1RETADORA3ADORA2AADORA2B
SCHEMBL12553253 0.85 ADORA1 (0.62) ADORA1RETSLC6A3ADORA3ADORA2A
SCHEMBL8034134 0.84 ADORA1 (0.63) ADORA1SLC6A3ADORA3ADORA2AADORA2B
SCHEMBL26010418 0.84 ADORA1 (0.79) ADORA1SLC6A3ADORA2BKDM4EALDH1A1
SCHEMBL13913745 0.84 ADORA1 (1.00) ADORA1ADORA3ADORA2AADORA2BKDM4E

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-20250170112-A1 ADENOSINE LIGANDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS LUCY THERAPEUTICS, INC. 2025-05-29 — — US disclosed
WO-2025101598-A1 BI-CYCLIC PYRIMIDINE COMPOUNDS, METHODS AND USES THEREOF ZENO MANAGEMENT, INC. (US) 2025-05-15 — — WO disclosed
WO-2025038783-A1 ADENOSINE LIGANDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS OR CHRONIC HEART FAILURE LUCY THERAPEUTICS, INC. (US) 2025-02-20 — — WO disclosed
EP-4479399-A1 ADENOSINE LIGANDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS Lucy Therapeutics, Inc. (US) 2024-12-25 — — EP disclosed
WO-2023158725-A1 ADENOSINE LIGANDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS LUCY THERAPEUTICS, INC. (US) 2023-08-24 — — WO disclosed
WO-2023158725-A1 ADENOSINE LIGANDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS LUCY THERAPEUTICS, INC. (US) 2023-08-24 — — 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-20250170112-A1 ADENOSINE LIGANDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS ADORA2A, ADORA1, PDE7A ADORA1 2/4885RET 136/4885SLC6A3 257/4885

“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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