SCHEMBL26057442

SCHEMBL26057442

C=C(CO)CCc1nn(C(C)C)c(C)c1Cc1ccc(OC(C)C)cc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 6/20 0.49
SLC5A2 P31639 6/20 0.49
HIF1A Q16665 1/20 0.38
MAPT P10636 3/20 0.37
KDM4A O75164 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
LMNA P02545 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 2/20 0.36
TP53 P04637 1/20 0.36
GAA P10253 1/20 0.35
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
POLB P06746 2/20 0.33
P2RX3 P56373 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL10031323 0.78 SLC5A1 (0.54) SLC5A1SLC5A2HIF1AMAPTKDM4A
SCHEMBL10064922 0.75 SLC5A1 (0.57) SLC5A1SLC5A2HIF1AMAPTKDM4A
SCHEMBL26892230 0.74 SLC5A2 (0.58) SLC5A1SLC5A2HIF1AMAPTKDM4A
SCHEMBL26892322 0.74 SLC5A1 (0.56) SLC5A1SLC5A2MAPTKDM4AKDM4C
SCHEMBL24921357 0.74 SLC5A2 (0.71) SLC5A1SLC5A2
SCHEMBL26816497 0.72 SLC5A2 (0.54) SLC5A1SLC5A2HIF1AMAPTKDM4A
SCHEMBL24952863 0.72 SLC5A2 (0.54) SLC5A1SLC5A2HIF1AMAPTKDM4A
SCHEMBL16845135 0.72 SLC5A1 (0.56) SLC5A1SLC5A2HIF1AMAPTKDM4A
SCHEMBL10031310 0.71 SLC5A1 (0.56) SLC5A1SLC5A2HIF1AMAPTKDM4A
SCHEMBL24980512 0.71 SLC5A1 (0.44) SLC5A1SLC5A2HIF1AMAPTLMNA

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
EP-4234012-A2 SGLT2 INHIBITORS FOR TREATMENT OF METABOLIC DISORDERS IN CANINE ANIMALS Boehringer Ingelheim Vetmedica GmbH (DE) 2023-08-30 EP disclosed