SCHEMBL31240684

SCHEMBL31240684

CSc1ccc(CC(=O)Nc2cc(Cl)ccn2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIOK2 Q9BVS4 6/20 0.62
MAPK10 P53779 4/20 0.62
GSK3A P49840 3/20 0.62
KMT2A Q03164 2/20 0.53
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MEN1 O00255 1/20 0.51
ALDH1A1 P00352 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
LOXL2 Q9Y4K0 1/20 0.50
RORC P51449 1/20 0.50
MAPK14 Q16539 3/20 0.49
POLB P06746 1/20 0.49
WNT3A P56704 1/20 0.48
MAPK8 P45983 1/20 0.47
HIPK1 Q86Z02 1/20 0.47
SNRK Q9NRH2 1/20 0.47
NPC1 O15118 1/20 0.47
GBA1 P04062 1/20 0.47
TP53 P04637 1/20 0.47

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
SCHEMBL31240668 0.85 RIOK2 (0.67) RIOK2MAPK10GSK3AKMT2ARAB9A
SCHEMBL31240659 0.82 RIOK2 (0.74) RIOK2MAPK10GSK3AKMT2ARAB9A
SCHEMBL31240699 0.82 MAPK10 (0.75) RIOK2MAPK10GSK3AKMT2ASMN1; SMN2
SCHEMBL31240607 0.81 MAPK10 (0.61) RIOK2MAPK10GSK3AKMT2ARAB9A
SCHEMBL31240713 0.80 RIOK2 (0.62) RIOK2MAPK10GSK3AKMT2ARAB9A
SCHEMBL31240719 0.77 MAPK10 (0.66) RIOK2MAPK10GSK3AKMT2ARAB9A
SCHEMBL31240687 0.75 RIOK2 (0.67) RIOK2MAPK10GSK3AKMT2ARAB9A
SCHEMBL11286425 0.74 GSK3A (0.54) RIOK2MAPK10GSK3AKMT2ARAB9A
SCHEMBL31240626 0.73 GSK3A (0.60) RIOK2MAPK10GSK3AKMT2ARAB9A
SCHEMBL22432119 0.72 ALDH1A1 (0.55) RIOK2MAPK10GSK3ARAB9ASMN1; SMN2

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
EP-4705291-A1 IKK-ALPHA INHIBITORS Cancer Research Technology Limited (GB) 2026-03-11 EP disclosed
WO-2024228035-A1 IKK-ALPHA INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2024-11-07 WO disclosed