SCHEMBL3628602

SCHEMBL3628602

CCC1NC(=S)N(CC(=O)O)C1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.46
ALDH1A1 P00352 2/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
GAA P10253 7/20 0.41
POLB P06746 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HTT P42858 1/20 0.40
PAX8 Q06710 1/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 0.40
GSK3A P49840 1/20 0.37
GSK3B P49841 1/20 0.37
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.35
MAPT P10636 2/20 0.35
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL8671548 0.75 KMT2A (0.51) NPSR1ALDH1A1CYP2C9CYP2C19GAA
SCHEMBL13170570 0.74 KMT2A (0.33) NPSR1KMT2ATSHRL3MBTL1SMN1; SMN2
SCHEMBL8385141 0.71 NPSR1 (0.59) NPSR1ALDH1A1CYP2C9CYP2C19GAA
SCHEMBL8663762 0.68 GAA (0.56) NPSR1ALDH1A1CYP2C9CYP2C19GAA
SCHEMBL6360842 0.68 LMNA (0.47) NPSR1ALDH1A1POLBHTTKMT2A
SCHEMBL12706784 0.67 ALDH1A1 (0.49) NPSR1ALDH1A1CYP2C9CYP2C19GAA
SCHEMBL13170563 0.67 ALOX15 (0.52) ALDH1A1HTTKMT2AMEN1GSK3A
SCHEMBL13170567 0.67 KMT2A (0.37) NPSR1ALDH1A1CYP2C9CYP2C19HTT
SCHEMBL22063690 0.66 LMNA (0.47) NPSR1ALDH1A1CYP2C9CYP2C19POLB
SCHEMBL12877356 0.66 GAA (0.70) ALDH1A1CYP2C9CYP2C19GAAPOLB

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-8395041-B2 Photoelectric conversion element and solor cell KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2013-03-12 US disclosed
US-20100288360-A1 PHOTOELECTRIC CONVERSION ELEMENT AND SOLOR CELL KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2010-11-18 US disclosed