SCHEMBL4492302

SCHEMBL4492302

Cc1ccc2nc(Cl)ccc2c1NC(=O)CC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 15/20 0.67
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
P2RX3 P56373 1/20 0.46

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
SCHEMBL4502026 0.90 P2RX7 (0.71) P2RX7
SCHEMBL13972099 0.88 P2RX7 (0.52) P2RX7P2RX3
SCHEMBL4500870 0.84 P2RX7 (0.61) P2RX7LMNASMN1; SMN2P2RX3
SCHEMBL4498495 0.83 P2RX7 (0.67) P2RX7LMNASMN1; SMN2P2RX3
SCHEMBL4501549 0.81 P2RX7 (0.59) P2RX7LMNASMN1; SMN2
SCHEMBL4510035 0.81 P2RX7 (0.73) P2RX7LMNASMN1; SMN2P2RX3
SCHEMBL4507223 0.81 P2RX7 (0.58) P2RX7LMNASMN1; SMN2P2RX3
SCHEMBL6484063 0.80 P2RX7 (0.62) P2RX7LMNASMN1; SMN2P2RX3
SCHEMBL4504565 0.80 P2RX7 (0.62) P2RX7LMNASMN1; SMN2P2RX3
SCHEMBL4507143 0.80 P2RX7 (0.57) P2RX7LMNASMN1; SMN2P2RX3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090018133-A1 Novel Adamantane Derivatives FORD RHONAN 2009-01-15 US claimed
US-20050090524-A1 Novel adamantane derivatives ASTRAZENECA AB (SE) 2005-04-28 US claimed
EP-1490341-A1 NOVEL ADAMANTANE DERIVATIVES AstraZeneca AB (SE) 2004-12-29 EP claimed
WO-2003080579-A1 NOVEL ADAMANTANE DERIVATIVES ASTRAZENECA AB (SE) 2003-10-02 WO claimed
US-20090018133-A1 Novel Adamantane Derivatives FORD RHONAN 2009-01-15 US disclosed
US-20090018133-A1 Novel Adamantane Derivatives FORD RHONAN 2009-01-15 US disclosed
US-20050090524-A1 Novel adamantane derivatives ASTRAZENECA AB (SE) 2005-04-28 US disclosed
EP-1490341-A1 NOVEL ADAMANTANE DERIVATIVES AstraZeneca AB (SE) 2004-12-29 EP disclosed
WO-2003080579-A1 NOVEL ADAMANTANE DERIVATIVES ASTRAZENECA AB (SE) 2003-10-02 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 (2 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-20090018133-A1 Novel Adamantane Derivatives ADRA1A, ADORA1, ADRA1D P2RX7 554/4885LMNA 1205/4885SMN1; SMN2 718/4885
US-20050090524-A1 Novel adamantane derivatives ADRA1A, ADORA1, ADRA1D P2RX7 732/4885LMNA 1999/4885SMN1; SMN2 626/4885

“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.