SCHEMBL11297030

SCHEMBL11297030

O=S(=O)(N=CSSC=NS(=O)(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.54
ALDH1A1 P00352 5/20 0.50
LMNA P02545 2/20 0.46
KDM4E B2RXH2 3/20 0.46
MAPT P10636 2/20 0.46
HTR6 P50406 1/20 0.42
ESR1 P03372 1/20 0.41
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TLR9 Q9NR96 1/20 0.40
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA3 P07451 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39

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
SCHEMBL3618544 0.79 KMT2A (0.47) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL1933484 0.78 ALDH1A1 (0.69) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL984789 0.78 ALDH1A1 (0.69) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL12699925 0.78 ALDH1A1 (0.69) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL12580250 0.76 ALDH1A1 (0.51) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL14399470 0.76 ALDH1A1 (0.51) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL8575541 0.72 ALDH1A1 (0.45) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL8575539 0.72 ALDH1A1 (0.45) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL28704383 0.72 KMT2A (0.56) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL1933592 0.71 ALDH1A1 (0.64) KMT2AALDH1A1LMNAKDM4EMAPT

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-4356025-A WITH THIOCARBAMATE HERBICIDES STAUFFER CHEMICAL COMPANY (US) 1982-10-26 US disclosed
US-4297295-A NONPHYTOTOXIC; CROPS STAUFFER CHEMICAL COMPANY (US) 1981-10-27 US disclosed