SCHEMBL10939675

SCHEMBL10939675

O=C(O)CC(C1CC2C=CC1C2)S(=O)(=O)O

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.35
KDM4E B2RXH2 4/20 0.35
LMNA P02545 1/20 0.33
PKM P14618 2/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL2070938 0.77 KDM4E (0.41) EPHX2KDM4ELMNATDP1
SCHEMBL4743391 0.77 KDM4E (0.37) EPHX2KDM4ELMNATDP1
SCHEMBL13119172 0.71 KDM4E (0.34) EPHX2KDM4ELMNATDP1
SCHEMBL11604002 0.68 KDM4E (0.38) EPHX2KDM4ELMNATDP1
SCHEMBL4740071 0.67 GPR84 (0.43) EPHX2KDM4E
SCHEMBL724697 0.67 KDM4E (0.37) EPHX2KDM4ELMNATDP1
SCHEMBL3293689 0.66 KDM4E (0.39) EPHX2KDM4ELMNATDP1
SCHEMBL22941781 0.66 KDM4E (0.39) EPHX2KDM4ELMNATDP1
SCHEMBL14053439 0.66 GRM5 (0.47) KDM4ELMNA
SCHEMBL11908054 0.66 KDM4E (0.36) EPHX2KDM4ELMNATDP1

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
US-4543166-A NICKEL, COBALT, ELECTRODEPOSITION, BRIGHTENERS, PUCTILITY, SULFONATES OMI INTERNATIONAL CORPORATION (US) 1985-09-24 US disclosed