SCHEMBL18860792

SCHEMBL18860792

CC1Cc2c(nnn2-c2ncc(F)cn2)CN1C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 19/20 0.67
CYP2C19 P33261 4/20 0.66

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
SCHEMBL16035402 0.85 P2RX7 (0.62) P2RX7CYP2C19
SCHEMBL16035401 0.85 P2RX7 (0.62) P2RX7CYP2C19
SCHEMBL16089652 0.81 P2RX7 (0.79) P2RX7CYP2C19
SCHEMBL16089651 0.81 P2RX7 (0.80) P2RX7CYP2C19
SCHEMBL16035723 0.81 P2RX7 (1.00) P2RX7CYP2C19
SCHEMBL16089650 0.81 P2RX7 (0.80) P2RX7CYP2C19
SCHEMBL16035721 0.81 P2RX7 (1.00) P2RX7CYP2C19
SCHEMBL16089646 0.81 P2RX7 (0.80) P2RX7CYP2C19
SCHEMBL16089662 0.81 P2RX7 (0.79) P2RX7CYP2C19
SCHEMBL16035604 0.80 P2RX7 (1.00) P2RX7CYP2C19

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970267-B3 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-30 EP disclosed
EP-3239151-A1 P2X7 MODULATORS Janssen Pharmaceutica NV (BE) 2017-11-01 EP disclosed
EP-2970267-B1 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2017-05-24 EP disclosed