SCHEMBL30898282

SCHEMBL30898282

Nc1ccccc1Cn1cnc2c(Cl)nc(Cl)nc21

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
YTHDC1 Q96MU7 6/20 0.72
HDAC1 Q13547 8/20 0.52
HDAC2 Q92769 7/20 0.52
HDAC6 Q9UBN7 8/20 0.49
HDAC4 P56524 7/20 0.49
HDAC3 O15379 6/20 0.49
HDAC7 Q8WUI4 6/20 0.49
HDAC10 Q969S8 6/20 0.49
HDAC11 Q96DB2 6/20 0.49
HDAC8 Q9BY41 6/20 0.49
HDAC9 Q9UKV0 6/20 0.49
HDAC5 Q9UQL6 6/20 0.49
NCOR2 Q9Y618 3/20 0.47
HSP90AA1 P07900 2/20 0.46
HSP90AB1 P08238 2/20 0.46
PDE8A O60658 2/20 0.46
P2RX7 Q99572 1/20 0.45

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
SCHEMBL22345218 0.86 YTHDC1 (0.54) YTHDC1P2RX7
SCHEMBL22345205 0.84 YTHDC1 (0.52) YTHDC1HDAC1HDAC2HDAC6HDAC4
SCHEMBL27388375 0.84 YTHDC1 (1.00) YTHDC1HDAC1HDAC2HDAC6HDAC4
SCHEMBL30898278 0.81 YTHDC1 (0.68) YTHDC1HDAC1HDAC2HDAC8P2RX7
SCHEMBL183057 0.81 YTHDC1 (0.68) YTHDC1HDAC1HDAC2HDAC8P2RX7
SCHEMBL22345214 0.81 YTHDC1 (0.75) YTHDC1HSP90AA1HSP90AB1PDE8A
SCHEMBL13596788 0.79 HDAC6 (0.57) YTHDC1HDAC1HDAC2HDAC6HDAC4
SCHEMBL1355219 0.78 YTHDC1 (0.71) YTHDC1HDAC1HDAC2HDAC6HDAC4
SCHEMBL3269795 0.76 ADORA2A (0.64) HDAC1HDAC2HDAC6HDAC4HDAC3
SCHEMBL22345216 0.76 LMNA (0.52) YTHDC1P2RX7

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-2024105159-A1 LIGANDS OF THE M6A-RNA READERS UNIVERSITY OF ZURICH (CH) 2024-05-23 WO disclosed