SCHEMBL308294

SCHEMBL308294

CC(=O)OCC(C)n1ccc2c(C(=O)NCC3(O)CCC(C(F)(F)F)CC3)c(Cl)ccc2c1=O

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 18/20 0.38
RORC P51449 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
SCHEMBL308293 1.00 P2RX7 (0.38) P2RX7RORC
SCHEMBL306309 0.90 P2RX7 (0.41) P2RX7RORC
SCHEMBL308572 0.90 P2RX7 (0.41) P2RX7RORC
SCHEMBL306616 0.88 P2RX7 (0.43) P2RX7
SCHEMBL306615 0.88 P2RX7 (0.43) P2RX7
SCHEMBL307036 0.88 P2RX7 (0.36) P2RX7
SCHEMBL307035 0.88 P2RX7 (0.36) P2RX7
SCHEMBL8135160 0.87 P2RX7 (0.36) P2RX7
SCHEMBL308292 0.83 P2RX7 (0.32) P2RX7
SCHEMBL306219 0.81 P2RX7 (0.51) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2124562-B1 BICYCLOHETEROARYL COMPOUNDS AS P2X7 MODULATORS AND USES THEREOF SECOND GENOME INC (US) 2016-04-20 EP disclosed
US-8093265-B2 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof RENOVIS, INC. (US) 2012-01-10 US disclosed
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