SCHEMBL29800385

SCHEMBL29800385

CCNC(=O)CC(=O)CCC(=O)CCC(=O)CCC(=O)CC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 1/20 0.43
▸ MCL1 Q07820 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.39
▸ KMT2A Q03164 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ KDM6B O15054 1/20 0.33
▸ KDM5C P41229 1/20 0.33
▸ EGLN1 Q9GZT9 1/20 0.33
▸ PHF8 Q9UPP1 1/20 0.33
▸ KDM2A Q9Y2K7 1/20 0.33
▸ MMP1 P03956 1/20 0.33
▸ MMP2 P08253 1/20 0.33
▸ MMP3 P08254 1/20 0.33
▸ MMP9 P14780 1/20 0.33
▸ MMP8 P22894 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ HDAC3 O15379 1/20 0.31
▸ HDAC1 Q13547 1/20 0.31
▸ HDAC2 Q92769 1/20 0.31

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
SCHEMBL10604328 0.85 TDP1 (0.47) FAAHMCL1TDP1KMT2AMEN1
SCHEMBL10607879 0.81 FAAH (0.52) FAAHMCL1MMP1MMP2MMP3
SCHEMBL28886374 0.80 MCL1 (0.50) FAAHMCL1TDP1KMT2AMEN1
SCHEMBL10608575 0.77 FAAH (0.59) FAAHMCL1KMT2A
SCHEMBL8371300 0.77 TDP1 (0.64) TDP1KMT2AKDM4EKDM6BKDM5C
SCHEMBL13379743 0.77 TDP1 (0.64) TDP1KMT2AKDM4EKDM6BKDM5C
SCHEMBL8984748 0.77 TDP1 (0.64) TDP1KMT2AKDM4EKDM6BKDM5C
SCHEMBL30255411 0.77 TDP1 (0.64) TDP1KMT2AKDM4EKDM6BKDM5C
SCHEMBL31303962 0.77 ADH1B (0.39) FAAHMCL1KMT2AMEN1
SCHEMBL23729623 0.76 FAAH (0.69) FAAHKMT2AMEN1HDAC3HDAC1

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
CN-114957219-B Degradation agent for targeted degradation of Gli1 protein, preparation method and application thereof 苏州大学 2023-12-15 — — CN disclosed
CN-114957219-A Degradation agent for targeted degradation of Gli1 protein and preparation method and application thereof 苏州大学 2022-08-30 — — CN disclosed
Send feedback