SCHEMBL31312950

SCHEMBL31312950

COC(=O)CC(=O)c1ccc(OC)cn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.45
P4HTM Q9NXG6 4/20 0.43
ALDH1A1 P00352 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
CYP1A2 P05177 1/20 0.43
POLB P06746 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
HPGD P15428 1/20 0.43
CYP2C19 P33261 1/20 0.43
ATM Q13315 1/20 0.43
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42

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
SCHEMBL22065262 0.83 DRD3 (0.47) DRD3P4HTMALDH1A1L3MBTL1CYP1A2
SCHEMBL29601112 0.81 GSK3B (0.56) DRD3P4HTMALDH1A1L3MBTL1CYP1A2
SCHEMBL27039929 0.81 DRD3 (0.46) DRD3P4HTMALDH1A1L3MBTL1CYP1A2
SCHEMBL21484711 0.81 GSK3B (0.56) DRD3P4HTMALDH1A1L3MBTL1CYP1A2
SCHEMBL22257011 0.80 KDM4E (0.53) ALDH1A1L3MBTL1CYP1A2HPGDATM
SCHEMBL31312576 0.80 MAOB (0.50) ALDH1A1L3MBTL1MAPK1MAPTRAB9A
SCHEMBL29514365 0.80 MAPK1 (0.41) P4HTMALDH1A1L3MBTL1MAPK1KDM4E
SCHEMBL30785982 0.80 KDM4E (0.53) ALDH1A1L3MBTL1CYP1A2HPGDATM
SCHEMBL29049994 0.80 MAPK1 (0.41) P4HTMALDH1A1L3MBTL1MAPK1KDM4E
Bromide SCHEMBL27039939 0.80 GSK3B (0.54) DRD3P4HTMALDH1A1L3MBTL1CYP1A2

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-4705296-A1 HETEROARYLINDOLE INHIBITORS OF APOL-1 OmniAB, Inc. (US) 2026-03-11 EP disclosed
WO-2024242846-A1 HETEROARYLINDOLE INHIBITORS OF APOL-1 OMNIAB, INC. (US) 2024-11-28 WO disclosed