SCHEMBL11025767

SCHEMBL11025767

CCOC(=O)N(C)SN(C)C(=O)F

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 5/20 0.36
LMNA P02545 2/20 0.34
HSD17B10 Q99714 1/20 0.34
GAA P10253 2/20 0.33
CYP2D6 P10635 1/20 0.33
ALOX15 P16050 1/20 0.33
MGAM O43451 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
SOAT1 P35610 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
TSHR P16473 2/20 0.32
TRPA1 O75762 1/20 0.31
CYP2C9 P11712 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
SCHEMBL11025762 0.82 ALDH1A1 (0.42) ALDH1A1LMNACYP2D6TSHRCYP2C9
SCHEMBL11024455 0.79 CHRNB2 (0.33) LMNATSHR
SCHEMBL11027703 0.79 CHRNB2 (0.33)
SCHEMBL11025027 0.79 TSHR (0.45) ALDH1A1LMNATSHR
SCHEMBL11027039 0.78 CHRM2 (0.32)
SCHEMBL11030318 0.78
SCHEMBL10659833 0.78 ALDH1A1 (0.30) ALDH1A1TSHR
SCHEMBL11031924 0.77 MEN1 (0.31) MEN1KMT2A
SCHEMBL11027207 0.77 CHRM2 (0.32)
SCHEMBL11024510 0.77

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
US-4479002-A CHEMICAL INTERMEDIATES FOR INSECTICIDES, PESTICIDES UNION CARBIDE CORPORATION (US) 1984-10-23 US claimed
US-4479002-A CHEMICAL INTERMEDIATES FOR INSECTICIDES, PESTICIDES UNION CARBIDE CORPORATION (US) 1984-10-23 US disclosed
US-4341795-A PESTICIDES; INSECTICIDES; MITICIDES UNION CARBIDE CORPORATION (US) 1982-07-27 US disclosed
EP-0007987-A1 N-sulfenylated carbamoyloximino-1-methylthio butanes, process for their preparation and their use as insecticides BAYER AG (DE) 1980-02-20 EP disclosed