SCHEMBL7815909

SCHEMBL7815909

COC(=O)Oc1ccc2c(c1C)S(=O)(=O)CCS2(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.36
HSD17B10 Q99714 2/20 0.36
HPGD P15428 1/20 0.36
MAPT P10636 2/20 0.35
HTT P42858 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
JAK2 O60674 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
GLA P06280 1/20 0.32
RECQL P46063 1/20 0.32
RYR2 Q92736 1/20 0.30
NCEH1 Q6PIU2 1/20 0.30

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
SCHEMBL7815067 0.81 HSD17B10 (0.33) KDM4EHSD17B10HPGDMAPTHTT
SCHEMBL7671509 0.76 KDM4E (0.38) KDM4EHSD17B10HPGDMAPTSMN1; SMN2
SCHEMBL7619023 0.70 CYP1A2 (0.34) KDM4EHSD17B10HPGDMAPTALDH1A1
SCHEMBL7624166 0.69 RYR2 (0.30) RYR2
SCHEMBL984617 0.69 NCEH1 (0.46) KDM4EHSD17B10HPGDMAPTHTT
SCHEMBL8602345 0.66 KDM4E (0.40) KDM4EHSD17B10HPGDMAPTHTT
SCHEMBL1598718 0.64 POLB (0.54) KDM4EHSD17B10HPGDMAPTALDH1A1
SCHEMBL7474688 0.63 KDM4E (0.35) KDM4EHSD17B10ALDH1A1RYR2
SCHEMBL6970278 0.63 KDM4E (0.37) KDM4EHSD17B10HPGDMAPTHTT
SCHEMBL8604736 0.63 KDM4E (0.40) KDM4EHSD17B10HPGDMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1135385-A1 THIOCHROMANOYLPYRAZOLONE DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2001-09-26 EP disclosed
WO-2000034270-A1 THIOCHROMANOYLPYRAZOLONE DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2000-06-15 WO disclosed