SCHEMBL28844976

SCHEMBL28844976

COCCOc1ccc(Cl)cc1NC(=O)Cc1ccccc1F

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.55
ALDH1A1 P00352 3/20 0.54
MEN1 O00255 4/20 0.54
GAA P10253 3/20 0.54
LMNA P02545 3/20 0.54
KDM4E B2RXH2 2/20 0.52
HPGD P15428 1/20 0.52
MAPT P10636 3/20 0.48
IRAK4 Q9NWZ3 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
LPAR1 Q92633 1/20 0.48
HTT P42858 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TP53 P04637 1/20 0.46

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
SCHEMBL29732923 1.00 KMT2A (0.55) KMT2AALDH1A1MEN1GAALMNA
SCHEMBL28844870 0.89 BACE1 (0.56) KMT2AALDH1A1MEN1GAALMNA
SCHEMBL29733128 0.89 BACE1 (0.56) KMT2AALDH1A1MEN1GAALMNA
SCHEMBL28844846 0.84 LMNA (0.59) KMT2AALDH1A1MEN1LMNAIRAK4
SCHEMBL29732903 0.84 LMNA (0.59) KMT2AALDH1A1MEN1LMNAIRAK4
SCHEMBL28844945 0.82 KMT2A (0.52) KMT2AALDH1A1MEN1LMNAKDM4E
SCHEMBL29732762 0.82 KMT2A (0.52) KMT2AALDH1A1MEN1LMNAKDM4E
SCHEMBL29733013 0.82 MEN1 (0.57) KMT2AALDH1A1MEN1LMNAKDM4E
SCHEMBL28844878 0.82 MEN1 (0.57) KMT2AALDH1A1MEN1LMNAKDM4E
SCHEMBL29732958 0.81 KCNQ2 (0.53) KMT2AALDH1A1MEN1LMNAKDM4E

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-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-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