SCHEMBL28844874

SCHEMBL28844874

COCCOc1ccc(Cl)cc1NC(=O)c1sccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 2/20 0.51
MAPT P10636 3/20 0.50
RAB9A P51151 1/20 0.50
POLB P06746 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
F10 P00742 1/20 0.48
NR4A2 P43354 3/20 0.47
KMT2A Q03164 4/20 0.46
KDM4E B2RXH2 3/20 0.46
HTT P42858 2/20 0.46
MEN1 O00255 1/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
ALDH1A1 P00352 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ESR1 P03372 1/20 0.45
ESR2 Q92731 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
SCHEMBL29684338 0.89 IRAK4 (0.49) IRAK4MAPTRAB9APOLBSMN1; SMN2
SCHEMBL29684829 0.85 IRAK4 (0.53) IRAK4MAPTRAB9APOLBSMN1; SMN2
SCHEMBL29684405 0.83 IRAK4 (0.55) IRAK4POLBKMT2AKDM4EHTT
SCHEMBL29732897 0.81 KCNMA1 (0.60) IRAK4MAPTPOLBSMN1; SMN2NPSR1
SCHEMBL28844941 0.81 KCNMA1 (0.60) IRAK4MAPTPOLBSMN1; SMN2NPSR1
SCHEMBL29684546 0.78 IRAK4 (0.55) IRAK4POLBKMT2AKDM4EHTT
SCHEMBL29684162 0.78 IRAK4 (0.50) IRAK4MAPTNPSR1KMT2AKDM4E
SCHEMBL1308558 0.78 F10 (0.55) MAPTRAB9APOLBSMN1; SMN2NPSR1
SCHEMBL29732956 0.78 HTT (0.70) IRAK4RAB9APOLBSMN1; SMN2KMT2A
SCHEMBL28844848 0.78 HTT (0.70) IRAK4RAB9APOLBSMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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