SCHEMBL4092996

SCHEMBL4092996

O=CCCc1ccc(Cl)c(C(=O)NCC23CCCC(CCC2)C3)c1.[CH2]

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 19/20 0.55

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
SCHEMBL7556017 0.91 P2RX7 (0.53) P2RX7
SCHEMBL5335179 0.88 P2RX7 (0.55) P2RX7
SCHEMBL14272604 0.88 P2RX7 (0.55) P2RX7
SCHEMBL7082380 0.87 P2RX7 (0.53) P2RX7
SCHEMBL7077648 0.87 P2RX7 (0.66) P2RX7
SCHEMBL4129931 0.86 P2RX7 (0.71) P2RX7
SCHEMBL7077870 0.85 P2RX7 (0.54) P2RX7
SCHEMBL6446984 0.85 P2RX7 (0.52) P2RX7
SCHEMBL5143075 0.85 P2RX7 (0.72) P2RX7
SCHEMBL7082054 0.85 P2RX7 (0.78) P2RX7

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2059497-A1 PROCESS FOR PREPARING N-METHYLADAMANTYL DERIVATIVES BY A PALLADIUM CATALYSED COUPLING REACTION FOLLOWED BY REDUCTIVE AMINATION AstraZeneca AB (SE) 2009-05-20 EP claimed
WO-2008030160-A1 PROCESS FOR PREPARING N-METHYLADAMANTYL DERIVATIVES BY A PALLADIUM CATALYSED COUPLING REACTION FOLLOWED BY REDUCTIVE AMINATION ASTRAZENECA AB (SE) 2008-03-13 WO claimed
US-20030013704-A1 Adamantane derivatives ASTRAZENECA AB (SE) 2003-01-16 US disclosed
EP-1242364-A1 ADAMANTANE DERIVATIVES AstraZeneca AB (SE) 2002-09-25 EP disclosed
WO-2001044170-A1 ADAMANTANE DERIVATIVES ASTRAZENECA AB (SE) 2001-06-21 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-20030013704-A1 Adamantane derivatives ADRA2C, CHRNA2, ADRA1D P2RX7 1500/4885

“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.