SCHEMBL31273166

SCHEMBL31273166

Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc(-c2c(C#N)c(-c3cc(C)nc(C)c3)c(-c3ccc(-n4c5ccc(C)cc5c5cc(C)ccc54)cc3)c(-n3c4ccccc4c4ccncc43)c2-n2c3ccccc3c3ccncc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE9A O76083 2/20 0.36
PDE1C Q14123 2/20 0.36
ALDH1A1 P00352 6/20 0.34
KDM4E B2RXH2 5/20 0.34
HPGD P15428 5/20 0.34
GAA P10253 3/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
RXFP1 Q9HBX9 3/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP11B2 P19099 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ELANE P08246 1/20 0.31
MDM2 Q00987 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL23296304 1.00 PDE9A (0.36) PDE9APDE1CALDH1A1KDM4EHPGD
SCHEMBL31273145 1.00 PDE9A (0.36) PDE9APDE1CALDH1A1KDM4EHPGD
SCHEMBL31273174 0.93 PDE9A (0.40) PDE9APDE1CALDH1A1KDM4EHPGD
SCHEMBL21396902 0.88 PDE9A (0.37) PDE9APDE1CALDH1A1KDM4EHPGD
SCHEMBL21396606 0.88 PDE9A (0.37) PDE9APDE1CALDH1A1KDM4EHPGD
SCHEMBL31273435 0.87 PDE9A (0.40) PDE9APDE1CALDH1A1KDM4EHPGD
SCHEMBL31272473 0.87 PDE9A (0.43) PDE9APDE1CALDH1A1KDM4EHPGD
SCHEMBL31400222 0.87 PDE9A (0.43) PDE9APDE1CALDH1A1KDM4EHPGD
SCHEMBL31273361 0.87 PDE9A (0.43) PDE9APDE1CALDH1A1KDM4EHPGD
SCHEMBL31272888 0.87 PDE9A (0.43) PDE9APDE1CALDH1A1KDM4EHPGD

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-4498784-A2 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES Kyulux, Inc. (JP) 2025-01-29 EP disclosed
EP-3775100-B1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES KYULUX INC (JP) 2025-01-22 EP disclosed