SCHEMBL27142178

SCHEMBL27142178

CN1CCN(c2cccc(C(=O)N3CCN(C(=O)[C@@H]4CCCN4C(=O)O)CC3)c2)CC1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.51
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
TSHR P16473 1/20 0.51
MAPK1 P28482 1/20 0.51
L3MBTL3 Q96JM7 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL29165129 1.00 USP2 (0.51) USP2LMNAMAPTTSHRMAPK1
SCHEMBL31049792 0.86 HSD17B10 (0.49) MAPTL3MBTL3L3MBTL1
SCHEMBL27145826 0.86 HSD17B10 (0.49) MAPTL3MBTL3L3MBTL1
SCHEMBL29165086 0.86 HSD17B10 (0.49) MAPTL3MBTL3L3MBTL1
SCHEMBL30019310 0.82 HRH2 (0.45) MAPTL3MBTL3L3MBTL1
Hydrochloric Acid SCHEMBL30019151 0.79 HRH2 (0.42) MAPT
SCHEMBL23868438 0.78 L3MBTL3 (0.64) USP2LMNAMAPTTSHRMAPK1
SCHEMBL27348451 0.78 KHK (0.52) USP2LMNAMAPTTSHRMAPK1
SCHEMBL28495248 0.78 HTT (0.49) LMNA
SCHEMBL18693576 0.78 HTT (0.49) LMNA

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 3 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
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

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 USP2 3619/4885LMNA 3812/4885MAPT 4359/4885

“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.