SCHEMBL31553919

SCHEMBL31553919

CC(C)(C)OC(=O)Cn1cc(C2OC(C)(C)C(C)(C)O2)cn1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ FFAR1 O14842 1/20 0.33
▸ WNT1 P04628 1/20 0.33
▸ GSK3B P49841 1/20 0.33
▸ DYRK1A Q13627 1/20 0.33
▸ SCD O00767 1/20 0.32
▸ PLA2G10 O15496 1/20 0.32
▸ PLA2G5 P39877 1/20 0.32
▸ ENPP2 Q13822 1/20 0.32
▸ HDAC3 O15379 1/20 0.31
▸ HDAC8 Q9BY41 1/20 0.31
▸ NCOR2 Q9Y618 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ JAK2 O60674 1/20 0.30
▸ JAK1 P23458 1/20 0.30
▸ JAK3 P52333 1/20 0.30
▸ LMNA P02545 1/20 0.30

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
SCHEMBL15647731 0.82 ROCK2 (0.39) SCDKMT2A
SCHEMBL21630620 0.80 PDK2 (0.36) FFAR1
SCHEMBL13172354 0.79 KDM4E (0.38) KDM4EALDH1A1WNT1GSK3BDYRK1A
SCHEMBL3599876 0.78 NR1H2 (0.38) JAK3
SCHEMBL844227 0.77 FFAR1 (0.60) KDM4EALDH1A1FFAR1WNT1GSK3B
SCHEMBL4156469 0.76 KDM4E (0.42) KDM4EALDH1A1WNT1GSK3BDYRK1A
SCHEMBL12460160 0.75 ALPI (0.47) KDM4EALDH1A1SCDENPP2HDAC3
SCHEMBL25247129 0.74 HSD17B10 (0.43) KDM4EALDH1A1SCDHDAC3HDAC8
SCHEMBL13172593 0.74 ALDH1A1 (0.40) KDM4EALDH1A1HDAC3HDAC8NCOR2
SCHEMBL24883514 0.74 KDM4E (0.43) KDM4EALDH1A1WNT1GSK3BDYRK1A

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-2025100970-A1 TNAP INHIBITORY COMPOUND AND USE THEREOF 주식회사 레드엔비아 2025-05-15 — — WO disclosed
Send feedback