SCHEMBL31267293

SCHEMBL31267293

CC1(C)OB(c2c(C#N)ccc(OCCOC3CCCCO3)c2F)OC1(C)C

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CHEK1 O14757 3/20 0.33
KDM4C Q9H3R0 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KDM4E B2RXH2 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
SCHEMBL248797 0.84 KDM4C (0.36) L3MBTL1MEN1KMT2ACHEK1KDM4C
SCHEMBL23835255 0.79 L3MBTL1 (0.40) L3MBTL1MEN1KMT2ACHEK1KDM4C
SCHEMBL29168261 0.78 L3MBTL1 (0.44) L3MBTL1MEN1KMT2ACHEK1KDM4C
SCHEMBL29233771 0.76 MEN1 (0.40) L3MBTL1MEN1KMT2AKDM4CNPC1
SCHEMBL1135556 0.74 MEN1 (0.36) L3MBTL1MEN1KMT2ACHEK1KDM4C
SCHEMBL29715583 0.74 MEN1 (0.36) L3MBTL1MEN1KMT2ACHEK1KDM4C
SCHEMBL247949 0.73 KDM4C (0.41) L3MBTL1MEN1KMT2ACHEK1KDM4C
SCHEMBL578792 0.73 MEN1 (0.50) L3MBTL1MEN1KMT2ACHEK1KDM4C
SCHEMBL30278920 0.73 ALDH1A1 (0.40) KDM4E
SCHEMBL10127747 0.72 MEN1 (0.43) L3MBTL1MEN1KMT2ACHEK1KDM4C

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-2024235254-A1 BIARYL COMPOUNDS PREPARATION METHODS AND MEDICINAL USES THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2024-11-21 WO disclosed