SCHEMBL8867071

SCHEMBL8867071

OC/C=C/c1cccc(NC(=S)Nc2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.53
ALDH1A1 P00352 4/20 0.52
CYP3A4 P08684 1/20 0.52
TAS2R38 P59533 1/20 0.52
HSD17B10 Q99714 1/20 0.52
MEN1 O00255 3/20 0.51
KDM4E B2RXH2 1/20 0.51
RHOA P61586 1/20 0.49
MAPT P10636 3/20 0.48
MAOB P27338 6/20 0.45
MAOA P21397 5/20 0.45
GAA P10253 2/20 0.45
LMNA P02545 1/20 0.45
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
NOX1 Q9Y5S8 1/20 0.44

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
SCHEMBL8867056 0.87 KMT2A (0.51) KMT2AALDH1A1CYP3A4TAS2R38HSD17B10
SCHEMBL8867437 0.87 ALDH1A1 (0.50) KMT2AALDH1A1CYP3A4MEN1KDM4E
SCHEMBL8867062 0.87 KMT2A (0.51) KMT2AALDH1A1CYP3A4TAS2R38HSD17B10
SCHEMBL8867294 0.85 MAOB (0.53) KMT2AHSD17B10MEN1RHOAMAPT
SCHEMBL8868163 0.85 MAPT (0.61) KMT2AALDH1A1CYP3A4MEN1KDM4E
SCHEMBL8867596 0.84 MAPT (0.51) KMT2AALDH1A1KDM4ERHOAMAPT
SCHEMBL8868030 0.83 KDM4E (0.43) KMT2AALDH1A1MEN1KDM4ERHOA
SCHEMBL8868531 0.82 KMT2A (0.56) KMT2AALDH1A1MEN1KDM4ERHOA
SCHEMBL8867766 0.75 NPC1 (0.57) KMT2AALDH1A1MEN1RHOAMAPT
SCHEMBL8867859 0.75 CA1 (0.51) KMT2AALDH1A1MEN1RHOAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5686484-A ANTHELMINTICS, ACARICIDES, INSECTICIDES SANKYO CO., LTD. (JP) 1997-11-11 US disclosed