SCHEMBL6559528

SCHEMBL6559528

CC1(C)Oc2ccc(OS(C)(=O)=O)cc2CC1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.43
CA5A P35218 2/20 0.43
KDM4E B2RXH2 7/20 0.40
ALDH1A1 P00352 7/20 0.40
HPGD P15428 2/20 0.40
GAA P10253 2/20 0.39
DRD3 P35462 1/20 0.37
ALPL P05186 2/20 0.36
ALPI P09923 1/20 0.36
CA12 O43570 2/20 0.36
MAPT P10636 5/20 0.34
LMNA P02545 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HTT P42858 1/20 0.34
PSMD14 O00487 1/20 0.34
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PLIN1 O60240 1/20 0.34

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
SCHEMBL7825575 0.81 CA2 (0.40) CA2CA5AKDM4EALDH1A1HPGD
SCHEMBL27410273 0.74 KDM4E (0.44) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL9692443 0.74 KDM4E (0.44) KDM4EALDH1A1HPGD
SCHEMBL28830167 0.71 MAPT (0.47) KDM4EALDH1A1HPGDGAAMAPT
SCHEMBL8794691 0.71 TDP2 (0.46) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL8645380 0.71 KDM4E (0.41) KDM4EALDH1A1HPGDLMNAPOLB
SCHEMBL7659637 0.70 ALDH1A1 (0.45) KDM4EALDH1A1HPGDLMNAPOLB
SCHEMBL8436289 0.69 KDM4E (0.40) KDM4EALDH1A1HPGD
SCHEMBL6561118 0.68 KDM4E (0.41) KDM4EALDH1A1HPGDGAAHTT
SCHEMBL17287663 0.68 CA2 (0.48) CA2CA5AKDM4EALDH1A1HPGD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0807629-B1 Sulfonamido substituted chromane derivatives, method for their preparation, their use as medicaments or diagnostic agents aswell as medicaments containing them AVENTIS PHARMA GMBH (DE) 2004-03-03 EP disclosed
US-6191164-B1 POTASSIUM CHANNEL MODULATORS; ANTIULCER AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 2001-02-20 US disclosed
EP-0807629-A1 Sulfonamido substituted chromane derivatives, method for their preparation, their use as medicaments or diagnostic agents aswell as medicaments containing them HOECHST AKTIENGESELLSCHAFT (DE) 1997-11-19 EP disclosed