SCHEMBL27650355

SCHEMBL27650355

Cc1ccsc1CCCC(=O)Oc1ccccc1O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 1/20 0.40
RECQL P46063 1/20 0.40
ALOX5 P09917 1/20 0.39
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA7 P43166 1/20 0.37
CA14 Q9ULX7 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
HPGD P15428 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36

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
SCHEMBL689958 0.77 KMT2A (0.51) MEN1KMT2AKDM4ERECQLLMNA
SCHEMBL688230 0.75 KMT2A (0.50) MEN1KMT2AKDM4ERECQLLMNA
SCHEMBL688760 0.75 KMT2A (0.50) MEN1KMT2AKDM4ERECQLLMNA
SCHEMBL7704726 0.75 HDAC1 (0.53) MEN1KMT2AKDM4ERECQLALOX5
SCHEMBL1246062 0.74 MEN1 (0.67) MEN1KMT2AKDM4ERECQLLMNA
SCHEMBL4644742 0.74 GAA (0.48) MEN1KMT2AKDM4ERECQLLMNA
SCHEMBL688269 0.73 GAA (0.54) MEN1KMT2AKDM4ERECQLLMNA
SCHEMBL2293567 0.73 MEN1 (0.60) MEN1KMT2AKDM4ERECQLLMNA
SCHEMBL4646991 0.73 KMT2A (0.47) MEN1KMT2AKDM4ERECQLLMNA
SCHEMBL6809052 0.73 LTB4R (0.50) MEN1KMT2AKDM4EALOX5MAPK1

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
CN-1946666-A Compounds, pharmaceutical compositions and methods for use in treating metabolic disorders AMGEN INC (US) 2007-04-11 CN disclosed