SCHEMBL4881659

SCHEMBL4881659

O=C(NCC12CC3CC(CC(C3)C1)C2)c1cc(Cl)ncc1Cl

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.67

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
SCHEMBL5710397 0.89 P2RX7 (0.62) P2RX7
SCHEMBL5710431 0.89 P2RX7 (0.62) P2RX7
SCHEMBL5710435 0.87 P2RX7 (0.60) P2RX7
SCHEMBL5773539 0.86 P2RX7 (0.50) P2RX7
SCHEMBL6662981 0.86 P2RX7 (0.71) P2RX7
SCHEMBL5710447 0.86 P2RX7 (0.59) P2RX7
SCHEMBL5710440 0.84 P2RX7 (0.80) P2RX7
SCHEMBL5710443 0.84 P2RX7 (0.75) P2RX7
SCHEMBL27616476 0.84 P2RX7 (0.57) P2RX7
SCHEMBL5710661 0.83 P2RX7 (0.60) 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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080153850-A1 Adamantyl Derivates as P2x7 Receptor Antagonists ASTRAZENECA AB (SE) 2008-06-26 US disclosed
EP-1448195-B1 N-ADAMANTYLMETHYL DERIVATES AND INTERMEDIATES AS PHARMACEUTICAL COMPOSITIONS AND PROCESSES FOR THEIR PREPARATION ASTRAZENECA AB (SE) 2006-11-02 EP disclosed
US-7129246-B2 N-adamantlmethyl derivatives and intermediates as pharmaceutical compositions and processes for their preparation ASTRAZENECA AB (SE) 2006-10-31 US disclosed
EP-1292590-B1 ADMANTANE DERIVATIVES ASTRAZENECA AB (SE) 2006-01-18 EP disclosed
US-6949539-B2 Admantane derivatives ASTRAZENECA AB (SE) 2005-09-27 US disclosed
US-20050010052-A1 N-adamantlmethyl derivatives and intermediates as pharmaceutical compositions and processes for their preparation ASTRAZENECA AB (SE) 2005-01-13 US disclosed
EP-1448195-A1 N-ADAMANTYLMETHYL DERIVATES AND INTERMEDIATES AS PHARMACEUTICAL COMPOSITIONS AND PROCESSES FOR THEIR PREPARATION AstraZeneca AB (SE) 2004-08-25 EP disclosed
US-20030187031-A1 Antiinflammatory agents; autoimmune disease; rheumatic disorders ASTRAZENECA AB (SE) 2003-10-02 US disclosed
WO-2003041707-A1 N-ADAMANTYLMETHYL DERIVATES AND INTERMEDIATES AS PHARMACEUTICAL COMPOSITIONS AND PROCESSES FOR THEIR PREPARATION ASTRAZENECA AB (SE) 2003-05-22 WO disclosed
EP-1292590-A1 ADMANTANE DERIVATIVES AstraZeneca AB (SE) 2003-03-19 EP disclosed
WO-2001094338-A1 ADMANTANE DERIVATIVES ASTRAZENECA AB (SE) 2001-12-13 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 (3 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-20080153850-A1 Adamantyl Derivates as P2x7 Receptor Antagonists ADORA1, P2RX1, P2RY1 P2RX7 4/4885
US-20030187031-A1 Antiinflammatory agents; autoimmune disease; rheumatic disorders IL1A, IL1R1, MTX1 P2RX7 432/4885
US-20050010052-A1 N-adamantlmethyl derivatives and intermediates as pharmaceutical compositions and processes for their preparation ADRA1A, ADRA1D, ADORA1 P2RX7 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.