SCHEMBL26708191

SCHEMBL26708191

N#Cc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(C(F)(F)F)cc3-n3c4ccccc4c4ccccc43)n2)c(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2C19 P33261 2/20 0.36
KMT2A Q03164 2/20 0.36
CLK4 Q9HAZ1 2/20 0.36
LMNA P02545 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ABCG2 Q9UNQ0 9/20 0.36
KIF11 P52732 2/20 0.36
ABCB1 P08183 2/20 0.36
DGAT1 O75907 1/20 0.34
SOAT1 P35610 1/20 0.34
KCNH2 Q12809 1/20 0.34
MAPK1 P28482 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 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
SCHEMBL20114535 0.96 ABCG2 (0.37) MEN1ALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL27016339 0.93 KIF11 (0.40) ABCG2KIF11ABCB1DGAT1SOAT1
SCHEMBL21741938 0.93 MAT2A (0.38) MEN1ALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL20114536 0.93 ABCG2 (0.39) MEN1ALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL27022443 0.92 CYP1A2 (0.41) MEN1ALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL21742002 0.90 CYP1A2 (0.43) MEN1ALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL20115131 0.90 CYP1A2 (0.43) MEN1ALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL26496869 0.90 KIF11 (0.43) LMNAABCG2KIF11
SCHEMBL20110534 0.90 KIF11 (0.43) LMNAABCG2KIF11
SCHEMBL22243174 0.90 CYP1A2 (0.36) MEN1ALDH1A1CYP1A2CYP3A4CYP2C19

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
US-20230345751-A1 ORGANIC ELECTROLUMINESCENT DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-10-26 US disclosed
US-20230345751-A1 ORGANIC ELECTROLUMINESCENT DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-10-26 US disclosed