SCHEMBL10907441

SCHEMBL10907441

O=C(Cc1c(Cl)csc1N1C(=O)C2=C(CCCC2)C1=O)OC1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP19A1 P11511 2/20 0.38
SLC6A3 Q01959 1/20 0.35
PTGS2 P35354 1/20 0.35
MAPK1 P28482 1/20 0.32
LMNA P02545 1/20 0.31
ELANE P08246 1/20 0.30
CYP2C19 P33261 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
SCHEMBL10907628 0.99 KDM4E (0.36) KDM4EALDH1A1HPGDHSD17B10CYP19A1
SCHEMBL10416239 0.72 SLC6A3 (0.40) KDM4EALDH1A1HPGDHSD17B10CYP19A1
SCHEMBL10786756 0.71 CYP19A1 (0.34) KDM4EALDH1A1HPGDHSD17B10CYP19A1
SCHEMBL10843729 0.71 PPOX (0.42)
SCHEMBL10546043 0.70 CYP19A1 (0.33) CYP19A1
SCHEMBL10598977 0.69 GRM7 (0.33)
SCHEMBL10596296 0.67 SLC6A3 (0.42) KDM4EALDH1A1HPGDHSD17B10SLC6A3
SCHEMBL9765187 0.66 SLC6A3 (0.41) ALDH1A1SLC6A3LMNA
SCHEMBL10786741 0.66 PPOX (0.38)
SCHEMBL10416238 0.66 SLC6A3 (0.40) ALDH1A1HPGDSLC6A3

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
US-4595409-A Substituted phenyl-4,5,6,7-tetrahydro-2H-isoindole-1,3-diones, and their production and use SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1986-06-17 US claimed
EP-0142648-A1 2-Substituted phenyl-4,5,6,7-tetrahydro-2h-isoindole-1,3 diones, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-05-29 EP claimed