SCHEMBL25567759

SCHEMBL25567759

N#Cc1ccc2c(c1)C1c3ccccc3C2c2cc(-c3ccc(-c4nc(-c5ccccc5)cc(-c5ccccc5)n4)cc3)c(C#N)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 3/20 0.44
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
ALDH1A1 P00352 3/20 0.42
MAPT P10636 3/20 0.42
HPGD P15428 3/20 0.42
ADORA1 P30542 5/20 0.40
ADORA2A P29274 4/20 0.40
KDM4E B2RXH2 3/20 0.40
LMNA P02545 3/20 0.40
GLA P06280 1/20 0.40
CSNK2A1 P68400 1/20 0.40
NTSR1 P30989 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
PIM1 P11309 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ABCB1 P08183 2/20 0.38
MAPK1 P28482 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38

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
SCHEMBL25568074 0.93 ABCG2 (0.41) ABCG2MEN1KMT2AALDH1A1MAPT
SCHEMBL25567694 0.88 MEN1 (0.40) ABCG2MEN1KMT2AALDH1A1MAPT
SCHEMBL25567820 0.88 STS (0.39) ADORA1ADORA2AMAOAMAOB
SCHEMBL25569555 0.84 CSNK2A1 (0.48) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL25567624 0.82 ADRA2C (0.38) ADORA1ADORA2AMAOAMAOB
SCHEMBL25565424 0.80 MEN1 (0.47) ABCG2MEN1KMT2AALDH1A1MAPT
SCHEMBL25567824 0.80 STS (0.40) MAOB
SCHEMBL25568572 0.77 ALDH1A1 (0.42) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL25872182 0.76 ABCG2 (0.61) ABCG2MEN1KMT2AALDH1A1MAPT
SCHEMBL25568680 0.75 STS (0.44) MAOA

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-2023094412-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-06-01 WO disclosed