SCHEMBL31048730

SCHEMBL31048730

CC(C)(C)c1cc2ccccc2[nH]c1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.59
DAO P14920 2/20 0.55
DDO Q99489 1/20 0.55
KDM4E B2RXH2 8/20 0.54
ALDH1A1 P00352 3/20 0.54
HPGD P15428 2/20 0.54
KDR P35968 2/20 0.51
CHEK1 O14757 1/20 0.51
GRIN2D O15399 2/20 0.48
GRIN3B O60391 2/20 0.48
GRIN1 Q05586 2/20 0.48
GRIN2A Q12879 2/20 0.48
GRIN2B Q13224 2/20 0.48
GRIN2C Q14957 2/20 0.48
GRIN3A Q8TCU5 2/20 0.48
TSHR P16473 3/20 0.46
HSD17B10 Q99714 3/20 0.46
PDGFRB P09619 1/20 0.45
FGFR1 P11362 1/20 0.45
CYP1A2 P05177 1/20 0.44

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
SCHEMBL837270 1.00 BRD4 (0.59) BRD4DAODDOKDM4EALDH1A1
SCHEMBL4017899 0.81 DAO (0.55) BRD4DAODDOKDM4EALDH1A1
SCHEMBL30556309 0.81 DAO (0.55) BRD4DAODDOKDM4EALDH1A1
SCHEMBL5475930 0.80 DAO (0.50) BRD4DAODDOKDM4EALDH1A1
SCHEMBL19545774 0.80 KDM4E (0.50) BRD4DAODDOKDM4EALDH1A1
SCHEMBL19779639 0.79 DAO (0.60) DAODDOKDM4EALDH1A1HPGD
SCHEMBL20193913 0.79 DAO (0.60) DAODDOKDM4EALDH1A1HPGD
SCHEMBL12395315 0.76 DAO (0.59) DAOKDM4EMAPT
SCHEMBL4310842 0.76 DAO (0.59) DAOKDM4EMAPT
SCHEMBL5473252 0.76 KDM4E (0.46) BRD4DAODDOKDM4EALDH1A1

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-4665407-A2 ANTISENSE OLIGOMER FORMULATIONS Stoke Therapeutics, Inc. (US) 2025-12-24 EP claimed
WO-2024173582-A2 ANTISENSE OLIGOMER FORMULATIONS STOKE THERAPEUTICS, INC. (US) 2024-08-22 WO claimed