SCHEMBL25119017

SCHEMBL25119017

N#Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2c1C1c3ccccc3C2c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ATM Q13315 1/20 0.40
ALDH1A1 P00352 3/20 0.32
HPGD P15428 2/20 0.32
MAPT P10636 2/20 0.32
CASP1 P29466 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HDAC4 P56524 1/20 0.31
IL1R1 P14778 1/20 0.31
LMNA P02545 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
PTGER4 P35408 1/20 0.31
MEN1 O00255 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL25119071 0.99 KDM4E (0.39) KDM4EL3MBTL1ATMALDH1A1HPGD
SCHEMBL25119452 0.96 KDM4E (0.37) KDM4EL3MBTL1ATMALDH1A1HPGD
SCHEMBL25119442 0.96 KDM4E (0.38) KDM4EL3MBTL1ATMALDH1A1HPGD
SCHEMBL25119411 0.96 KDM4E (0.35) KDM4EL3MBTL1ATMALDH1A1HPGD
SCHEMBL25119021 0.93 CYP11B1 (0.35) KDM4EL3MBTL1ATMALDH1A1HPGD
SCHEMBL25119066 0.93 L3MBTL1 (0.40) KDM4EL3MBTL1ATMALDH1A1HPGD
SCHEMBL25119403 0.93 KDM4E (0.33) KDM4EL3MBTL1ATMALDH1A1HPGD
SCHEMBL25565084 0.90 KDM4E (0.33) KDM4EL3MBTL1ATMALDH1A1HPGD
SCHEMBL25119449 0.89 KDM4E (0.36) KDM4EL3MBTL1ATMALDH1A1HPGD
SCHEMBL25119395 0.89 KDM1A (0.33) ALDH1A1HPGDLMNAMAPK1SMN1; SMN2

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
WO-2023052272-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-04-06 WO disclosed