SCHEMBL24485451

SCHEMBL24485451

Cc1ncccc1COc1ccc2oc(C)c(C(=O)N[C@@H](CO)C(N)=O)c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC26A4 O43511 6/20 0.51
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.48
MAPT P10636 4/20 0.46
LMNA P02545 4/20 0.46
TSHR P16473 2/20 0.46
GAA P10253 2/20 0.45
CASP3 P42574 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
POLB P06746 3/20 0.45
NPSR1 Q6W5P4 2/20 0.45
KDM4E B2RXH2 1/20 0.44
MAPK1 P28482 2/20 0.43
MAPK10 P53779 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 1/20 0.42
PTGS2 P35354 1/20 0.42

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
SCHEMBL29629633 1.00 SLC26A4 (0.51) SLC26A4KMT2AMEN1MAPTLMNA
SCHEMBL29095405 1.00 SLC26A4 (0.51) SLC26A4KMT2AMEN1MAPTLMNA
SCHEMBL31153337 0.92 SLC26A4 (0.50) SLC26A4KMT2AMEN1MAPTLMNA
SCHEMBL24484416 0.92 SLC26A4 (0.50) SLC26A4KMT2AMEN1MAPTLMNA
SCHEMBL24485119 0.92 SLC26A4 (0.50) SLC26A4KMT2AMEN1MAPTLMNA
SCHEMBL29629958 0.92 SLC26A4 (0.50) SLC26A4KMT2AMEN1MAPTLMNA
SCHEMBL29629729 0.92 SLC26A4 (0.50) SLC26A4KMT2AMEN1MAPTLMNA
SCHEMBL24484993 0.91 SLC26A4 (0.48) SLC26A4KMT2AMEN1MAPTLMNA
SCHEMBL29630059 0.91 SLC26A4 (0.48) SLC26A4KMT2AMEN1MAPTLMNA
SCHEMBL31153334 0.90 SLC26A4 (0.48) SLC26A4KMT2AMEN1MAPTLMNA

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-116745283-A Heterocyclic derivatives for the treatment of TRPM3 mediated disorders 勒芬天主教大学 2023-09-12 CN claimed
CN-116745283-A Heterocyclic derivatives for the treatment of TRPM3 mediated disorders 勒芬天主教大学 2023-09-12 CN disclosed
WO-2022112352-A1 HETEROCYCLE DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2022-06-02 WO disclosed