SCHEMBL11284075

SCHEMBL11284075

COC(=O)CNC(=S)NN

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 1/20 0.48
RECQL P46063 1/20 0.47
ALDH1A1 P00352 3/20 0.46
LMNA P02545 2/20 0.46
TSHR P16473 5/20 0.39
HSD17B10 Q99714 4/20 0.39
GAA P10253 4/20 0.38
KDM4E B2RXH2 4/20 0.38
EPHX2 P34913 1/20 0.38
CA12 O43570 2/20 0.36
CA2 P00918 2/20 0.36
CA1 P00915 1/20 0.36
CA9 Q16790 1/20 0.36
MGAM O43451 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CA14 Q9ULX7 1/20 0.33

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
SCHEMBL10470968 0.82 GAA (0.50) ALDH1A1LMNATSHRGAAKDM4E
SCHEMBL27687085 0.77
SCHEMBL1596926 0.77 ALDH1A1 (0.49) TET2RECQLALDH1A1LMNATSHR
SCHEMBL9674229 0.75
SCHEMBL9457498 0.75
SCHEMBL11282182 0.75
SCHEMBL9673883 0.74 TSHR (0.38) ALDH1A1LMNATSHRHSD17B10GAA
SCHEMBL27729676 0.73
SCHEMBL11290372 0.72 ALDH1A1 (0.35) ALDH1A1LMNAGAAKDM4EMEN1
SCHEMBL12421853 0.72

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-4361437-A HERBICIDES, FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-11-30 US disclosed
EP-0035833-A1 3-Thiooxo-5-oxo-hexahydro-1,2,4-triazine and its production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-09-16 EP disclosed