SCHEMBL9214501

SCHEMBL9214501

S=C1c2ccccc2C2(c3cccc4cc5ccccc5cc34)SCCN12

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GAA P10253 2/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLC6A3 Q01959 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
SCHEMBL9210497 0.88 SLC6A3 (0.40) KDM4EALDH1A1MEN1MAPTKMT2A
SCHEMBL9701779 0.78 NPC1 (0.34) MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL9701510 0.77 SLC6A3 (0.33) SLC6A3
SCHEMBL9211283 0.77 NPC1 (0.35) MEN1MAPTKMT2ASLC6A3
SCHEMBL9699426 0.74 SLC6A4 (0.40) SLC6A3
SCHEMBL9196513 0.73 SLC6A3 (0.32) KDM4EALDH1A1GAAMEN1MAPT
SCHEMBL9217152 0.73 CES1 (0.38) MEN1MAPTKMT2ASMN1; SMN2SLC6A3
SCHEMBL9208150 0.73
SCHEMBL9216408 0.73 MEN1 (0.33) MEN1KMT2A
SCHEMBL6362220 0.73 SLC6A3 (0.40) KDM4EALDH1A1MEN1MAPTKMT2A

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-0569457-B1 USE OF THIAZOLO-[2,3-A]ISOINDOLE DERIVATIVES AS ANTIVIRAL MEDICAMENTS AND NOVEL THIAZOLO- [2,3-A]ISOINDOLE DERIVATIVES BOEHRINGER MANNHEIM GMBH (DE) 1995-06-14 EP disclosed
EP-0569457-A1 USE OF THIAZOLO- 2,3-A]ISOINDOLE DERIVATIVES AS ANTIVIRAL MEDICAMENTS AND NOVEL THIAZOLO- 2,3-A]ISOINDOLE DERIVATIVES. BOEHRINGER MANNHEIM GMBH (DE) 1993-11-18 EP disclosed
WO-1992013863-A1 USE OF THIAZOLO-[2,3-A]ISOINDOLE DERIVATIVES AS ANTIVIRAL MEDICAMENTS AND NOVEL THIAZOLO-[2,3-A]ISOINDOLE DERIVATIVES BOEHRINGER MANNHEIM GMBH (DE) 1992-08-20 WO disclosed