SCHEMBL7672501

SCHEMBL7672501

COCc1c(C(=O)O)ccc2c1S(=O)(=O)CCS2(=O)=O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RYR2 Q92736 1/20 0.32
KDM5A P29375 1/20 0.32
KDM5B Q9UGL1 1/20 0.32
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL7619023 0.75 CYP1A2 (0.34) RYR2KDM4EPOLB
SCHEMBL7670644 0.73 ALDH1A1 (0.36) KDM4EPOLB
SCHEMBL7671509 0.69 KDM4E (0.38) KDM4EPOLB
SCHEMBL9077199 0.66 KMO (0.44) KDM5AKDM5BKDM4E
SCHEMBL27594631 0.66 APEX1 (0.38) KDM5AKDM5BKDM4EPOLB
SCHEMBL27684495 0.66 ALDH1A1 (0.41) KDM5AKDM5BKDM4EPOLB
SCHEMBL7624166 0.65 RYR2 (0.30) RYR2
SCHEMBL6772585 0.65 TDP1 (0.41) RYR2KDM4EPOLB
SCHEMBL16280257 0.64 ALDH1A1 (0.52) KDM4EPOLB
SCHEMBL27766125 0.64 TDP1 (0.46) KDM4EPOLB

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-6352959-B1 HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2002-03-05 US disclosed