SCHEMBL24029934

SCHEMBL24029934

C#CCN(C)C(=O)CN1CCN(C(=O)C(C)(C)NC(=O)C/C=C/c2ccc(Cc3ccccc3C)cc2)CC1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 9/20 0.36
SLC5A2 P31639 7/20 0.36
LMNA P02545 3/20 0.35
ANXA2 P07355 3/20 0.33
S100A10 P60903 3/20 0.33
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
MAPK1 P28482 1/20 0.33
MEN1 O00255 1/20 0.31
USP2 O75604 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL24029612 0.85 SLC5A1 (0.47) SLC5A1SLC5A2
SCHEMBL24030128 0.84 SLC5A1 (0.58) SLC5A1SLC5A2
SCHEMBL26552778 0.83 SLC5A1 (0.46) SLC5A1SLC5A2
SCHEMBL24029919 0.78 SLC5A1 (0.37) SLC5A1SLC5A2
SCHEMBL24029939 0.75 SLC5A1 (0.39) SLC5A1SLC5A2
SCHEMBL24038321 0.71 SLC5A1 (0.38) SLC5A1SLC5A2LMNAMEN1KMT2A
SCHEMBL26552776 0.70 SLC5A1 (0.63) SLC5A1SLC5A2
SCHEMBL26555757 0.69 SLC5A1 (0.56) SLC5A1SLC5A2
SCHEMBL26552817 0.69 SLC5A1 (0.60) SLC5A1SLC5A2
SCHEMBL24029892 0.68 CHRM2 (0.36) ALDH1A1TSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021227440-A1 A CLASS OF ARYL GLUCOSIDE DERIVATIVES, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 上海喆邺生物科技有限公司 2021-11-18 WO disclosed