SCHEMBL24867282

SCHEMBL24867282

Cc1cc(Nc2cnc(Nc3ccc(OC(C)C)cc3)nc2)ccn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 4/20 0.50
HDAC3 O15379 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
BRD4 O60885 2/20 0.41
JAK2 O60674 1/20 0.39
SCN9A Q15858 2/20 0.39
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TTBK1 Q5TCY1 1/20 0.38
TTBK2 Q6IQ55 1/20 0.38
KCNH2 Q12809 1/20 0.38
SCN5A Q14524 1/20 0.38
ADRA2A P08913 1/20 0.37
GPR65 Q8IYL9 1/20 0.37
PTGIR P43119 1/20 0.37

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
SCHEMBL24866862 0.80 HDAC3 (0.48) HDAC3HDAC1HDAC2HDAC6JAK2
SCHEMBL18835026 0.77 SYK (0.51) SYKNPC1MAPTRAB9AKMT2A
SCHEMBL24867198 0.75 HDAC3 (0.49) HDAC3HDAC1HDAC2HDAC6SCN9A
SCHEMBL24867280 0.73 SYK (0.49) SYKBRD4SCN9ANPC1MAPT
SCHEMBL24866902 0.72 HDAC3 (0.46) SYKHDAC3HDAC1HDAC2HDAC6
SCHEMBL24867272 0.72 SYK (0.60) SYKNPC1MAPTRAB9AKMT2A
SCHEMBL24867176 0.72 HDAC3 (0.46) HDAC3HDAC1HDAC2HDAC6KCNH2
SCHEMBL2723103 0.72 GLA (0.57) SYKNPC1MAPTRAB9AKMT2A
SCHEMBL24867305 0.71 SYK (0.49) SYKALDH1A1LMNATP53MAPK1
SCHEMBL10048417 0.71 SYK (0.48) SYKNPC1MAPTRAB9AKMT2A

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
WO-2023283488-A9 CDK19-SELECTIVE INHIBITORS, AND METHODS OF USE THEREOF CZ BIOHUB SF, LLC (US) 2023-05-25 WO disclosed
WO-2023283488-A2 CDK19-SELECTIVE INHIBITORS, AND METHODS OF USE THEREOF CHAN ZUCKERBERG BIOHUB, INC. (US) 2023-01-12 WO disclosed