SCHEMBL28844848

SCHEMBL28844848

COCCOc1ccc(Cl)cc1NC(=O)c1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.70
KMT2A Q03164 5/20 0.59
KDM4E B2RXH2 4/20 0.59
IRAK4 Q9NWZ3 1/20 0.57
KCNMA1 Q12791 1/20 0.57
ALDH1A1 P00352 4/20 0.56
HPGD P15428 2/20 0.56
L3MBTL1 Q9Y468 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
MAPK1 P28482 1/20 0.55
LMNA P02545 1/20 0.55
HDAC1 Q13547 2/20 0.54
HDAC8 Q9BY41 2/20 0.54
HDAC6 Q9UBN7 2/20 0.54
MEN1 O00255 3/20 0.54
POLB P06746 1/20 0.54
NPC1 O15118 2/20 0.53
CYP1A2 P05177 2/20 0.53
CYP2C9 P11712 2/20 0.53
CYP2C19 P33261 2/20 0.53

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
SCHEMBL29732956 1.00 HTT (0.70) HTTKMT2AKDM4EIRAK4KCNMA1
SCHEMBL10889701 0.85 MAPK1 (0.72) KMT2AKDM4EKCNMA1ALDH1A1L3MBTL1
SCHEMBL29732914 0.85 IRAK4 (0.63) HTTKMT2AKDM4EIRAK4ALDH1A1
SCHEMBL28844843 0.85 IRAK4 (0.63) HTTKMT2AKDM4EIRAK4ALDH1A1
SCHEMBL29732903 0.84 LMNA (0.59) HTTKMT2AIRAK4ALDH1A1L3MBTL1
SCHEMBL28844846 0.84 LMNA (0.59) HTTKMT2AIRAK4ALDH1A1L3MBTL1
SCHEMBL29684423 0.83 KCNMA1 (0.60) HTTKMT2AKDM4EIRAK4KCNMA1
SCHEMBL29732921 0.82 SMN1; SMN2 (0.77) KMT2AKDM4EIRAK4ALDH1A1HPGD
SCHEMBL28844943 0.82 SMN1; SMN2 (0.77) KMT2AKDM4EIRAK4ALDH1A1HPGD
SCHEMBL29732897 0.81 KCNMA1 (0.60) HTTKMT2AKDM4EIRAK4KCNMA1

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
CN-114763347-A Compound for inducing mesenchymal stem cells to differentiate towards cartilage and application thereof 华东师范大学 2022-07-19 CN claimed
CN-114763347-B Compound for inducing mesenchymal stem cells to differentiate into cartilage and application thereof 华东师范大学 2024-06-21 CN disclosed
CN-114763347-A Compound for inducing mesenchymal stem cells to differentiate towards cartilage and application thereof 华东师范大学 2022-07-19 CN disclosed