SCHEMBL11192533

SCHEMBL11192533

O=C(O)Cn1c(=S)oc2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.53
ALDH1A1 P00352 5/20 0.52
APEX1 P27695 1/20 0.51
KDM4E B2RXH2 1/20 0.51
KMT2A Q03164 6/20 0.51
MEN1 O00255 5/20 0.51
HTT P42858 2/20 0.50
POLB P06746 1/20 0.50
HPGD P15428 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
NPC1 O15118 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
MAPK1 P28482 1/20 0.48
GLA P06280 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
GFER P55789 1/20 0.47
LMNA P02545 1/20 0.47
RAB9A P51151 1/20 0.47
MDM2 Q00987 1/20 0.47
PAX8 Q06710 1/20 0.47

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
SCHEMBL11196544 0.85 HPGD (0.69) MAPTALDH1A1KMT2AMEN1HTT
SCHEMBL6893802 0.84 MAPT (0.65) MAPTALDH1A1APEX1KMT2AMEN1
SCHEMBL2947194 0.81 HPGD (0.73) ALDH1A1HTTHPGDNPSR1MAPK1
SCHEMBL17156221 0.76 MIF (0.68) MAPTALDH1A1POLBHPGDMAPK1
SCHEMBL1101916 0.75 ALDH1A1 (0.54) MAPTALDH1A1KMT2AMEN1HTT
SCHEMBL11074949 0.75 MAPT (0.51) MAPTALDH1A1KMT2AMEN1HTT
SCHEMBL11556953 0.72 ALDH1A1 (0.62) MAPTALDH1A1KMT2AMEN1HTT
SCHEMBL14246927 0.72 ALDH1A1 (0.58) MAPTALDH1A1KMT2AMEN1HTT
SCHEMBL7814099 0.72 PTPN1 (0.52) MAPTALDH1A1KMT2AMEN1HTT
SCHEMBL9873167 0.71 MAPT (0.45) MAPTALDH1A1KDM4EKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4422865-A HERBICIDES AND PLANT GROWTH REGULANTS MONSANTO COMPANY (US) 1983-12-27 US disclosed
US-4362547-A HERBICIDES; PLANT GROWTH REGULATORS MONSANTO COMPANY (US) 1982-12-07 US disclosed
US-4289886-A HERBICIDES, PLANT GROWTH REGULATORS MONSANTO COMPANY (US) 1981-09-15 US disclosed