SCHEMBL6572928

SCHEMBL6572928

CC(O)CNCCOc1ccc(Cl)c(C(=O)NCC23CC4CC(CC(C4)C2)C3)c1

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
SCHEMBL6571501 1.00 P2RX7 (0.67) P2RX7
SCHEMBL6571386 1.00 P2RX7 (0.67) P2RX7
Hydrochloric Acid SCHEMBL6573385 0.99 P2RX7 (0.66) P2RX7
Hydrochloric Acid SCHEMBL6572046 0.99 P2RX7 (0.66) P2RX7
SCHEMBL7459173 0.89 P2RX7 (0.53) P2RX7
SCHEMBL6572999 0.86 P2RX7 (0.66) P2RX7
SCHEMBL6572989 0.86 P2RX7 (0.66) P2RX7
SCHEMBL6573013 0.86 P2RX7 (0.66) P2RX7
SCHEMBL6571668 0.86 P2RX7 (0.66) P2RX7
SCHEMBL6572850 0.86 P2RX7 (0.72) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6720452-B2 SUBSTITUTED BENZMIDE-N-METHYL ADMANATANE DERIVATIVES USEFUL FOR TREATMENT OF RHEUMATOID ARTHRITIS AND CHRONIC OBSTRUCTIVE PULMONARY DISEASE ASTRAZENECA AB (SE) 2004-04-13 US claimed
EP-1240132-B1 ADAMANTANE DERIVATIVES ASTRAZENECA AB (SE) 2004-04-07 EP claimed
US-6720452-B2 SUBSTITUTED BENZMIDE-N-METHYL ADMANATANE DERIVATIVES USEFUL FOR TREATMENT OF RHEUMATOID ARTHRITIS AND CHRONIC OBSTRUCTIVE PULMONARY DISEASE ASTRAZENECA AB (SE) 2004-04-13 US disclosed
EP-1240132-B1 ADAMANTANE DERIVATIVES ASTRAZENECA AB (SE) 2004-04-07 EP disclosed
EP-1240132-A1 ADAMANTANE DERIVATIVES AstraZeneca AB (SE) 2002-09-18 EP disclosed
WO-2001042194-A1 ADAMANTANE DERIVATIVES ASTRAZENECA AB (SE) 2001-06-14 WO disclosed