SCHEMBL27340900

SCHEMBL27340900

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CC2CCC(C1)N2C(=O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.55
▸ UCHL1 P09936 3/20 0.53
▸ NPC1 O15118 1/20 0.47
▸ HRH2 P25021 1/20 0.47
▸ HRH1 P35367 1/20 0.47
▸ WNT3 P56703 2/20 0.46
▸ SFRP1 Q8N474 2/20 0.46
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ KLK7 P49862 1/20 0.44

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
Hydrochloric Acid SCHEMBL30020095 0.90 UCHL1 (0.46) HSD17B10UCHL1NPC1HRH2HRH1
SCHEMBL27154398 0.84 — —
SCHEMBL27143853 0.83 KDM4E (0.50) MEN1KMT2A
SCHEMBL5408443 0.78 NPC1 (0.57) HSD17B10UCHL1NPC1HRH2HRH1
SCHEMBL3530509 0.78 NPC1 (0.57) HSD17B10UCHL1NPC1HRH2HRH1
SCHEMBL24896686 0.78 HSD17B10 (0.58) HSD17B10UCHL1NPC1HRH2HRH1
Hydrochloric Acid SCHEMBL30020380 0.76 KDM4E (0.47) MEN1KMT2A
SCHEMBL27150678 0.76 KDM4E (0.44) MEN1KMT2A
SCHEMBL1251121 0.75 NPC1 (0.53) HSD17B10UCHL1NPC1HRH2HRH1
SCHEMBL2136252 0.75 NPC1 (0.53) HSD17B10UCHL1NPC1HRH2HRH1

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-20240217978-A1 COMPOUND AS ADENOSINE A2a RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITION COMPRISING SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2024-07-04 — — US disclosed
US-20240217978-A1 COMPOUND AS ADENOSINE A2a RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITION COMPRISING SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2024-07-04 — — US disclosed
US-20240217978-A1 COMPOUND AS ADENOSINE A2a RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITION COMPRISING SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2024-07-04 — — US disclosed
EP-4326724-A1 COMPOUND AS ADENOSINE A2A RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Chong Kun Dang Pharmaceutical Corp. (KR) 2024-02-28 — — EP disclosed
CN-117120443-A Compounds as adenosine A2a receptor antagonists and pharmaceutical compositions containing the same 株式会社 钟根堂 2023-11-24 — — CN disclosed
WO-2022224180-A1 COMPOUND AS ADENOSINE A2A RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITION COMPRISING SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2022-10-27 — — 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-20240217978-A1 COMPOUND AS ADENOSINE A2a RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITION COMPRISING SAME ADORA2A, ADORA1, ADORA2B HSD17B10 2827/4885UCHL1 4251/4885NPC1 1517/4885

“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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