SCHEMBL8525256

SCHEMBL8525256

C=CCc1ccccc1OS(=O)(=O)OCC=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.40
ALDH1A1 P00352 3/20 0.38
HTR1A P08908 3/20 0.36
ADRA2C P18825 2/20 0.36
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
NISCH Q9Y2I1 1/20 0.36
ADRB2 P07550 5/20 0.36
ADRB1 P08588 3/20 0.36
LMNA P02545 2/20 0.36
ADRB3 P13945 1/20 0.36
SLC6A2 P23975 1/20 0.36
BDKRB2 P30411 1/20 0.36
SLC6A4 P31645 1/20 0.36
ADRA1A P35348 1/20 0.36
HTR2B P41595 1/20 0.36
KCNH2 Q12809 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
TSHR P16473 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
SCHEMBL2422286 0.86 KDM4E (0.44) KDM4EALDH1A1HTR1AADRA2CADRA2A
SCHEMBL8769688 0.84 MAPT (0.41) KDM4EALDH1A1HTR1AADRA2CADRA2A
Ether SCHEMBL4296253 0.78 MAPT (0.41) KDM4EALDH1A1HTR1AADRA2CADRA2A
SCHEMBL10754824 0.77 KDM4E (0.40) KDM4EALDH1A1HTR1AADRA2CADRA2A
SCHEMBL15951533 0.77 KDM4E (0.40) KDM4EALDH1A1HTR1AADRA2CADRA2A
SCHEMBL174594 0.76 ALDH1A1 (0.44) KDM4EALDH1A1HTR1AADRA2CADRA2A
SCHEMBL10719408 0.76 CA2 (0.46) KDM4EALDH1A1HTR1AADRA2CADRA2A
SCHEMBL29006872 0.76 ALDH1A1 (0.44) KDM4EALDH1A1HTR1AADRA2CADRA2A
SCHEMBL3267413 0.75 MAPT (0.40) KDM4EALDH1A1HTR1AADRA2CADRA2A
SCHEMBL5755350 0.75 POLB (0.41) KDM4EALDH1A1HTR1AADRA2CADRA2A

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-0602173-B1 TOPICAL FIBRINOGEN COMPLEX BAXTER INT (US) 1999-05-26 EP claimed