SCHEMBL27154017

SCHEMBL27154017

O=C([C@@H]1CCCN1C(=O)O)N1CCCN(c2ccc(F)cc2F)CC1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
DPP4 P27487 1/20 0.45
DPP9 Q86TI2 1/20 0.45
GRM5 P41594 2/20 0.44
MAPT P10636 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PREP P48147 1/20 0.40

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
SCHEMBL29165103 1.00 LMNA (0.46) LMNADPP4DPP9GRM5MAPT
Hydrochloric Acid SCHEMBL27147078 0.91 LMNA (0.40) LMNADPP4DPP9GRM5MAPT
SCHEMBL29165097 0.86 HSD17B10 (0.52) LMNAMAPT
SCHEMBL27340981 0.86 HSD17B10 (0.52) LMNAMAPT
SCHEMBL27152739 0.81 DPP4 (0.50) DPP4MEN1KMT2A
SCHEMBL29165081 0.81 DPP4 (0.50) DPP4MEN1KMT2A
Hydrochloric Acid SCHEMBL30020106 0.78 HSD17B10 (0.43) LMNAMAPT
SCHEMBL27146221 0.76 CCR4 (0.45) DPP4DPP9GRM5
SCHEMBL27146224 0.76 CCR4 (0.45) DPP4DPP9GRM5
SCHEMBL632171 0.76 GRM5 (0.59) LMNADPP4DPP9GRM5MAPT

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 LMNA 3812/4885DPP4 2306/4885DPP9 1933/4885

“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.