SCHEMBL22201565

SCHEMBL22201565

N#Cc1ccnc2cc(-c3ccncc3)nc(Nc3ccc4nc(C5CC5)sc4c3)c12

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ROCK2 O75116 3/20 0.34
P2RX3 P56373 7/20 0.33
ABL1 P00519 3/20 0.33
BCR P11274 1/20 0.33
SRC P12931 1/20 0.33
FGFR2 P21802 1/20 0.32
FLT3 P36888 1/20 0.32
JAK2 O60674 2/20 0.32
JAK1 P23458 2/20 0.32
MKNK1 Q9BUB5 1/20 0.30
IKBKE Q14164 1/20 0.30
TBK1 Q9UHD2 1/20 0.30
IKBKB O14920 1/20 0.30
CHUK O15111 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
SCHEMBL22201328 0.90 ABL1 (0.38) P2RX3ABL1BCRSRC
SCHEMBL22201245 0.87 SYK (0.42) MEN1KMT2AROCK2P2RX3SRC
SCHEMBL22201402 0.86 MEN1 (0.36) KDM4EMEN1KMT2AROCK2P2RX3
SCHEMBL22201401 0.86 KDM4E (0.36) KDM4EMEN1KMT2AROCK2P2RX3
SCHEMBL22201404 0.86 P2RX3 (0.38) KDM4EMEN1KMT2AROCK2P2RX3
SCHEMBL22201399 0.84 MEN1 (0.37) KDM4EMEN1KMT2AROCK2P2RX3
SCHEMBL22201400 0.84 KMT2A (0.37) KDM4EMEN1KMT2AROCK2P2RX3
SCHEMBL22201403 0.83 ROCK2 (0.35) KDM4EMEN1KMT2AROCK2P2RX3
SCHEMBL22201564 0.82 RIPK1 (0.36) KDM4EMEN1KMT2AROCK2P2RX3
SCHEMBL22201586 0.81 PRKCH (0.47) KDM4EMEN1KMT2AROCK2

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-2020142748-A1 METHODS AND MATERIALS FOR INCREASING TRANSCRIPTION FACTOR EB POLYPEPTIDE LEVELS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2020-07-09 WO disclosed