SCHEMBL4996419

SCHEMBL4996419

CCC(C1CCCN1)N1CCc2c(NC(=O)CC34CC5CC(CC(C5)C3)C4)cccc2C1=O

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 13/20 0.49

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
SCHEMBL4995119 0.81 P2RX7 (0.45) P2RX7
SCHEMBL4142225 0.80 P2RX7 (0.51) P2RX7
SCHEMBL13243891 0.80 P2RX7 (0.58) P2RX7
SCHEMBL13243892 0.80 P2RX7 (0.58) P2RX7
SCHEMBL4132901 0.80 P2RX7 (0.57) P2RX7
SCHEMBL4994112 0.79 P2RX7 (0.66) P2RX7
SCHEMBL23867068 0.78 P2RX7 (0.60) P2RX7
SCHEMBL4999038 0.77 P2RX7 (0.46) P2RX7
SCHEMBL4984968 0.76 P2RX7 (0.45) P2RX7
SCHEMBL4135931 0.75 P2RX7 (0.46) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7402596-B2 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof RENOVIS, INC. (US) 2008-07-22 US claimed