SCHEMBL20184300

SCHEMBL20184300

CCOc1cccnc1-n1nnc2c1CCN(C=O)C2C

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 19/20 0.56
POLB P06746 1/20 0.34

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
SCHEMBL20184288 0.86 P2RX7 (0.54) P2RX7
SCHEMBL20184308 0.84 P2RX7 (0.52) P2RX7
SCHEMBL20184289 0.78 P2RX7 (0.50) P2RX7
SCHEMBL17244877 0.74 P2RX7 (0.80) P2RX7
SCHEMBL16089684 0.74 P2RX7 (0.80) P2RX7
SCHEMBL16036449 0.72 P2RX7 (1.00) P2RX7
SCHEMBL16036349 0.72 P2RX7 (1.00) P2RX7
SCHEMBL20184305 0.71 P2RX7 (0.37) P2RX7
SCHEMBL18880941 0.70 P2RX7 (0.53) P2RX7
SCHEMBL19524407 0.70 P2RX7 (0.56) 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
EP-2970267-B3 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-30 EP claimed