SCHEMBL23598569

SCHEMBL23598569

N#Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(CCCCCO)c2cc1C#N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.49
▸ KMT2A Q03164 7/20 0.49
▸ USP2 O75604 4/20 0.49
▸ KDM4E B2RXH2 4/20 0.49
▸ MAPT P10636 4/20 0.49
▸ HTT P42858 3/20 0.49
▸ TDP1 Q9NUW8 2/20 0.49
▸ RXFP1 Q9HBX9 2/20 0.49
▸ IDO1 P14902 1/20 0.49
▸ HAT1 O14929 4/20 0.45
▸ RBBP7 Q16576 4/20 0.45
▸ RECQL P46063 3/20 0.45
▸ CASP7 P55210 3/20 0.45
▸ CASP1 P29466 2/20 0.45
▸ BRCA1 P38398 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ TST Q16762 2/20 0.45
▸ LMNA P02545 1/20 0.45
▸ HBB P68871 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45

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
SCHEMBL23598608 0.91 MEN1 (0.53) MEN1KMT2AUSP2KDM4EMAPT
SCHEMBL24636097 0.88 MEN1 (0.50) MEN1KMT2AUSP2KDM4EMAPT
SCHEMBL23598685 0.86 MEN1 (0.48) MEN1KMT2AUSP2KDM4EMAPT
SCHEMBL23598654 0.85 MEN1 (0.55) MEN1KMT2AUSP2KDM4EMAPT
SCHEMBL864291 0.84 MEN1 (0.67) MEN1KMT2AUSP2KDM4EMAPT
SCHEMBL23598610 0.84 KDM4E (0.53) MEN1KMT2AUSP2KDM4EMAPT
SCHEMBL23598611 0.84 MEN1 (0.50) MEN1KMT2AUSP2KDM4EMAPT
SCHEMBL864974 0.83 MEN1 (0.69) MEN1KMT2AUSP2KDM4EMAPT
SCHEMBL24636077 0.83 MEN1 (0.48) MEN1KMT2AUSP2KDM4EMAPT
SCHEMBL23578704 0.82 MEN1 (0.49) MEN1KMT2AUSP2KDM4EMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4083043-A1 NOVEL ORGANIC ELECTRON TRANSFER MEDIATOR AND DEVICE COMPRISING SAME I-SENS, INC. (KR) 2022-11-02 — — EP disclosed
CN-114981271-A Novel organic electron transfer mediator and device comprising same 爱-森新株式会社 2022-08-30 — — CN disclosed
WO-2021133144-A1 NOVEL ORGANIC ELECTRON TRANSFER MEDIATOR AND DEVICE COMPRISING SAME 주식회사 아이센스 2021-07-01 — — WO disclosed
Send feedback