SCHEMBL29948811

SCHEMBL29948811

CCOC(=O)C1(C(=O)OCC)CN(S(=O)(=O)c2ccc(Cl)cc2Cl)C1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.54
HTT P42858 2/20 0.51
GAA P10253 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TSHR P16473 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
ALDH1A1 P00352 2/20 0.46
TRPV4 Q9HBA0 7/20 0.45
POLB P06746 1/20 0.45
TRPM8 Q7Z2W7 2/20 0.45
KCNH2 Q12809 1/20 0.45
NPC1 O15118 1/20 0.44
KMT2A Q03164 1/20 0.44
LMNA P02545 1/20 0.43
KDM2B Q8NHM5 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
SCHEMBL23390426 1.00 MAPT (0.54) MAPTHTTGAASMN1; SMN2TSHR
SCHEMBL23424683 0.87 MAPT (0.51) MAPTHTTGAASMN1; SMN2TSHR
SCHEMBL29948752 0.87 MAPT (0.51) MAPTHTTGAASMN1; SMN2TSHR
SCHEMBL23390557 0.83 MAPT (0.50) MAPTHTTGAASMN1; SMN2TSHR
SCHEMBL29948715 0.83 MAPT (0.50) MAPTHTTGAASMN1; SMN2TSHR
SCHEMBL23424682 0.80 MAPT (0.47) MAPTHTTGAASMN1; SMN2TSHR
SCHEMBL29948746 0.80 MAPT (0.47) MAPTHTTGAASMN1; SMN2TSHR
SCHEMBL29948913 0.74 TRPV4 (0.73) TRPV4TRPM8KCNH2
SCHEMBL23390454 0.74 TRPV4 (0.73) TRPV4TRPM8KCNH2
SCHEMBL31449963 0.74 TSHR (0.54) MAPTHTTGAASMN1; SMN2TSHR

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-119118894-A TRPV4 receptor ligands 犹他大学研究基金会 2024-12-13 CN disclosed
EP-4061124-A1 TRPV4 RECEPTOR LIGANDS University of Utah Research Foundation (US) 2022-09-28 EP disclosed
CN-115052478-A TRPV4 receptor ligands 犹他大学研究基金会 2022-09-13 CN disclosed