SCHEMBL10790638

SCHEMBL10790638

C=CCOC(=O)NCC(=O)S

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.38
CACNA1B Q00975 1/20 0.38
APBA1 Q02410 1/20 0.38
CYP3A4 P08684 1/20 0.36
CASP1 P29466 8/20 0.35
TSHR P16473 2/20 0.34
ERN1 O75460 2/20 0.33
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
CSNK2A2 P19784 1/20 0.32
CSNK2A1 P68400 1/20 0.32
HSD17B10 Q99714 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL4680857 0.82 CASP1 (0.45) MEN1KMT2AMAPTCACNA1BAPBA1
SCHEMBL248893 0.81
SCHEMBL19672930 0.80 MEN1 (0.38) MEN1KMT2AMAPTCACNA1BAPBA1
SCHEMBL9129459 0.80 MEN1 (0.38) MEN1KMT2AMAPTCACNA1BAPBA1
SCHEMBL20793437 0.80 MEN1 (0.38) MEN1KMT2AMAPTCACNA1BAPBA1
SCHEMBL4684975 0.80 MEN1 (0.41) MEN1KMT2AMAPTCACNA1BAPBA1
SCHEMBL9547232 0.80 MAPT (0.46) MEN1KMT2AMAPTCACNA1BAPBA1
SCHEMBL2343808 0.80 MEN1 (0.38) MEN1KMT2AMAPTCACNA1BAPBA1
SCHEMBL13055388 0.79 MAPT (0.42) MEN1KMT2AMAPTCACNA1BAPBA1
SCHEMBL9486696 0.79 MAPT (0.42) MEN1KMT2AMAPTCACNA1BAPBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4656165-A Aminomethyl penem compounds CIBA-GEIGY CORPORATION (US) 1987-04-07 US disclosed