SCHEMBL8779854

SCHEMBL8779854

NNC(=S)NCS(=O)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.38
LMNA P02545 3/20 0.35
TAAR1 Q96RJ0 1/20 0.35
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 3/20 0.32
SLC6A6 P31641 1/20 0.31
CYP2C19 P33261 1/20 0.31
BLM P54132 1/20 0.31
PTGS2 P35354 1/20 0.30
HSD17B10 Q99714 1/20 0.30
KDM4E B2RXH2 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
SCHEMBL4142693 0.75
SCHEMBL17758585 0.75 ALDH1A1 (0.32) LMNAALDH1A1KDM4E
SCHEMBL12727665 0.69 GAA (0.52) GAALMNATAAR1KMT2AALDH1A1
SCHEMBL6681807 0.69
SCHEMBL10113928 0.69 GAA (0.47) GAALMNATAAR1KMT2AALDH1A1
SCHEMBL17758584 0.68 MEN1 (0.31) KMT2AALDH1A1
SCHEMBL23328424 0.67 KMT2A (0.46) GAALMNAKMT2AALDH1A1KDM4E
SCHEMBL11502752 0.67
SCHEMBL11502753 0.67 IDO1 (0.38) KMT2ACYP2C19BLMKDM4E
Sulfuric Acid SCHEMBL28899531 0.67 TDP1 (0.36) LMNAALDH1A1SLC6A6CYP2C19BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0635001-B1 SUBSTITUTED THIOUREAS AS BIFUNCTIONAL CHELATORS CYTOGEN CORP (US) 1997-08-20 EP disclosed
US-5585468-A MEDICAL DIAGNOSIS; TUMOR IMAGING CYTOGEN CORPORATION (US) 1996-12-17 US disclosed
US-5527885-A USEFUL FOR DELIVERING DRUGS OR RADIOISOTOPES TO TARGET ORGANS, TUMORS OR THROMBI IN VIVO CYTOGEN CORPORATION (US) 1996-06-18 US disclosed
US-5326856-A For radioimaging of organs or tumors CYTOGEN CORPORATION (US) 1994-07-05 US disclosed