SCHEMBL11154231

SCHEMBL11154231

CNC(=O)O/N=C(\C)OC

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.37
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CYP2D6 P10635 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRNB2 P17787 1/20 0.30
NFKB1 P19838 1/20 0.30
CHRM3 P20309 1/20 0.30
MAPK1 P28482 1/20 0.30
CHRNA7 P36544 1/20 0.30
CHRNA4 P43681 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
SCHEMBL11154234 1.00 TDP1 (0.37) TDP1ALDH1A1TSHRHSD17B10CHRM2
SCHEMBL10982684 0.80
SCHEMBL27316167 0.77 TDP1 (0.33) TDP1ALDH1A1TSHRHSD17B10
SCHEMBL21861805 0.76
SCHEMBL9297548 0.76
SCHEMBL988589 0.76
SCHEMBL11860983 0.74 TDP1 (0.33) TDP1ALDH1A1TSHRHSD17B10CHRM2
SCHEMBL11574649 0.73
Carbamic Acid SCHEMBL27400526 0.73 TDP1 (0.30) TDP1
Methomyl SCHEMBL27111 0.73 TDP1 (0.43) TDP1ALDH1A1TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4405796-A Processes for making phosphorus derivatives of aminothiomethylcarbamates THE UPJOHN COMPANY (US) 1983-09-20 US disclosed
US-4354975-A Processes for making phosphorus derivatives of aminothiomethylcarbamates THE UPJOHN COMPANY (US) 1982-10-19 US disclosed
US-4336207-A Phosphorus derivatives of aminothiocarbamoyl halides THE UPJOHN COMPANY (US) 1982-06-22 US disclosed
US-4279840-A Processes for making phosphorus containing aminothiocarbamoyl halides THE UPJOHN COMPANY (US) 1981-07-21 US disclosed
US-4279839-A Processes for making phosphorus containing aminothiocarbamoyl halides THE UPJOHN COMPANY (US) 1981-07-21 US disclosed
US-4234521-A Phosphorus derivatives of aminothiocarbamoyl halides THE UPJOHN COMPANY (US) 1980-11-18 US disclosed