SCHEMBL4880412

SCHEMBL4880412

O=C(NCC12CC3CC(CC(C3)C1)C2)c1cc(-c2cnccc2C(=O)O)ccc1Cl

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 18/20 0.68
KDM5A P29375 1/20 0.53
KDM5B Q9UGL1 1/20 0.53

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
SCHEMBL4885209 0.92 P2RX7 (0.68) P2RX7KDM5AKDM5B
SCHEMBL4880557 0.86 P2RX7 (0.72) P2RX7
SCHEMBL4881070 0.84 P2RX7 (0.79) P2RX7
SCHEMBL4876616 0.83 P2RX7 (0.68) P2RX7
SCHEMBL4880689 0.82 P2RX7 (0.67) P2RX7
SCHEMBL4877538 0.82 P2RX7 (0.69) P2RX7
SCHEMBL4875200 0.82 P2RX7 (0.66) P2RX7
SCHEMBL4882192 0.81 P2RX7 (1.00) P2RX7
SCHEMBL4880025 0.81 P2RX7 (0.68) P2RX7
SCHEMBL4874411 0.81 P2RX7 (0.68) 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 4 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 claimed
US-20080153850-A1 Adamantyl Derivates as P2x7 Receptor Antagonists ASTRAZENECA AB (SE) 2008-06-26 US disclosed
US-20080153850-A1 Adamantyl Derivates as P2x7 Receptor Antagonists ASTRAZENECA AB (SE) 2008-06-26 US disclosed
US-20080153850-A1 Adamantyl Derivates as P2x7 Receptor Antagonists ASTRAZENECA AB (SE) 2008-06-26 US 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-20080153850-A1 Adamantyl Derivates as P2x7 Receptor Antagonists ADORA1, P2RX1, P2RY1 P2RX7 4/4885KDM5A 3267/4885KDM5B 3802/4885

“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.