SCHEMBL20923622

SCHEMBL20923622

Cc1cc(-c2ccncc2)c(C#N)cc1-n1c2ccccc2c2ccc(-c3cc(C#N)cc(C#N)c3)cc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SQOR Q9Y6N5 1/20 0.34
XDH P47989 1/20 0.34
CYP2C19 P33261 2/20 0.33
KDM4E B2RXH2 1/20 0.33
PDE5A O76074 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
PTGS1 P23219 1/20 0.33
PDE4A P27815 1/20 0.33
BLM P54132 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
MAPK14 Q16539 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
PIK3R2 O00459 1/20 0.33

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
SCHEMBL20923859 0.95 XDH (0.36) XDHCYP2C19KDM4EPDE5ALMNA
SCHEMBL20923631 0.94 PTGER4 (0.35) SQORXDHCYP2C19KDM4EPDE5A
SCHEMBL20923681 0.93 CHEK1 (0.37) SQORXDHCYP2C19KDM4EPDE5A
SCHEMBL19909519 0.92 FLT3 (0.34) SQORXDHHPGDMAPK14CYP11B1
SCHEMBL20923560 0.91 SQOR (0.40) SQORXDHCYP2C19KDM4EPDE5A
SCHEMBL20923579 0.91 LMNA (0.36) XDHCYP2C19KDM4EPDE5ALMNA
SCHEMBL20923269 0.90 PTGER4 (0.34) SQORXDHCYP2C19KDM4EPDE5A
SCHEMBL20923820 0.90 CYP11B1 (0.37) SQORXDHCYP2C19KDM4EPDE5A
SCHEMBL20924121 0.89 CYP11B1 (0.39) SQORXDHCYP2C19KDM4EPDE5A
SCHEMBL20923860 0.89 SQOR (0.36) SQORXDHCYP2C19HPGDMAPK14

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-3266772-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-04-24 EP disclosed