SCHEMBL30087458

SCHEMBL30087458

Cc1cccc(-c2ccn(-c3cc(N4CCOCC4)n4nc(C)cc4n3)n2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.54
HSD17B10 Q99714 4/20 0.54
GAA P10253 2/20 0.54
MAPK1 P28482 2/20 0.54
HPGD P15428 6/20 0.49
ALDH1A1 P00352 4/20 0.48
KMT2A Q03164 4/20 0.48
MAPT P10636 4/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
TSHR P16473 2/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 2/20 0.46
HCRTR1 O43613 1/20 0.46
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL23665909 1.00 KDM4E (0.54) KDM4EHSD17B10GAAMAPK1HPGD
SCHEMBL23649529 0.91 KDM4E (0.51) KDM4EHSD17B10GAAMAPK1HPGD
SCHEMBL29546975 0.91 KDM4E (0.51) KDM4EHSD17B10GAAMAPK1HPGD
SCHEMBL23649069 0.89 KDM4E (0.52) KDM4EHSD17B10GAAMAPK1HPGD
SCHEMBL30041218 0.89 KDM4E (0.52) KDM4EHSD17B10GAAMAPK1HPGD
SCHEMBL23773716 0.89 RAD52 (0.56) KDM4EHSD17B10GAAMAPK1HPGD
SCHEMBL31731628 0.89 RAD52 (0.56) KDM4EHSD17B10GAAMAPK1HPGD
SCHEMBL25270148 0.89 KDM4E (0.48) KDM4EHSD17B10GAAMAPK1HPGD
SCHEMBL31731482 0.89 PIKFYVE (0.59) KDM4EHSD17B10GAAMAPK1HPGD
SCHEMBL23649076 0.89 PIKFYVE (0.59) KDM4EHSD17B10GAAMAPK1HPGD

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
EP-4103281-A1 PIKFYVE KINASE INHIBITORS Acurastem Inc. (US) 2022-12-21 EP disclosed