SCHEMBL4556543

SCHEMBL4556543

[CH2][C@H](C)n1ccc2c(C(=O)N(C)C3(O)CCCCCC3)c(Cl)ccc2c1=O

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.35
CCR6 P51684 2/20 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
SCHEMBL306614 0.85 P2RX7 (0.33) P2RX7
SCHEMBL4556544 0.79 P2RX7 (0.47) P2RX7
SCHEMBL307034 0.77 P2RX7 (0.33) P2RX7
SCHEMBL308133 0.68 P2RX7 (0.46) P2RX7
SCHEMBL306895 0.68 P2RX7 (0.46) P2RX7
SCHEMBL307485 0.68 P2RX7 (0.46) P2RX7
SCHEMBL305933 0.66 P2RX7 (0.36) P2RX7
SCHEMBL306217 0.64 P2RX7 (0.34) P2RX7
SCHEMBL8140694 0.64 P2RX7 (0.38) P2RX7
SCHEMBL4438657 0.63 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2124562-A1 BICYCLOHETEROARYL COMPOUNDS AS P2X7 MODULATORS AND USES THEREOF Renovis, Inc. (US) 2009-12-02 EP disclosed
WO-2008112205-A1 BICYCLOHETEROARYL COMPOUNDS AS P2X7 MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2008-09-18 WO disclosed