SCHEMBL7013161

SCHEMBL7013161

CCCCC(=O)Oc1c(Br)cccc1OCCn1c(C)nc2ccccc2c1=O

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EIF4EBP1 Q13541 2/20 0.48
TSHR P16473 1/20 0.47
GAA P10253 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HTR1A P08908 1/20 0.43
HTR7 P34969 1/20 0.43
MAPT P10636 4/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 4/20 0.43
HPGD P15428 2/20 0.43
ACKR3 P25106 2/20 0.43
MAPK1 P28482 1/20 0.43
KDM4E B2RXH2 2/20 0.42
LMNA P02545 1/20 0.42
GFER P55789 1/20 0.42
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL6858495 0.89 EIF4EBP1 (0.49) EIF4EBP1TSHRGAAL3MBTL1HTR1A
SCHEMBL6555761 0.82 EIF4EBP1 (0.52) EIF4EBP1TSHRGAAHTR1AHTR7
SCHEMBL6555789 0.81 EIF4EBP1 (0.50) EIF4EBP1TSHRHTR1AHTR7MAPT
SCHEMBL7004272 0.78 HTR2C (0.34) EIF4EBP1GAAMEN1KMT2AKDM4E
SCHEMBL6858494 0.75 EIF4EBP1 (0.49) EIF4EBP1TSHRGAAHTR1AHTR7
SCHEMBL6858499 0.73 EIF4EBP1 (0.49) EIF4EBP1TSHRHTR1AHTR7MAPT
SCHEMBL6555851 0.72 MAPT (0.47) EIF4EBP1L3MBTL1HTR7MAPTALDH1A1
SCHEMBL15558636 0.71 KMT2A (0.56) MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL6557890 0.71 ALDH1A1 (0.44) EIF4EBP1L3MBTL1MAPTALDH1A1HPGD
SCHEMBL7797529 0.71 EIF4EBP1 (0.49) EIF4EBP1TSHRGAAHTR1AHTR7

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-0958296-B1 HETEROCYCLIC COMPOUNDS PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED DISEASES REDDYS LAB LTD DR (IN) 2003-07-30 EP disclosed