SCHEMBL9873167

SCHEMBL9873167

C=CCn1c(=S)oc2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
ALDH1A1 P00352 6/20 0.44
HPGD P15428 2/20 0.43
MAPK1 P28482 2/20 0.43
USP2 O75604 1/20 0.43
TSHR P16473 1/20 0.43
MEN1 O00255 6/20 0.43
KMT2A Q03164 6/20 0.43
POLB P06746 3/20 0.42
HTT P42858 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NPC1 O15118 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
LMNA P02545 1/20 0.41
RAB9A P51151 1/20 0.41
MDM2 Q00987 1/20 0.41
PAX8 Q06710 1/20 0.41
KDM4E B2RXH2 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MIF P14174 1/20 0.40

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
SCHEMBL11779421 0.79 MAPK1 (0.43) MAPTALDH1A1HPGDMAPK1USP2
SCHEMBL11074949 0.77 MAPT (0.51) MAPTALDH1A1HPGDMAPK1USP2
SCHEMBL1101916 0.77 ALDH1A1 (0.54) MAPTALDH1A1HPGDMAPK1USP2
SCHEMBL11556953 0.74 ALDH1A1 (0.62) MAPTALDH1A1HPGDMAPK1MEN1
SCHEMBL17156221 0.74 MIF (0.68) MAPTALDH1A1HPGDMAPK1USP2
SCHEMBL11192533 0.71 MAPT (0.53) MAPTALDH1A1HPGDMAPK1MEN1
SCHEMBL19499958 0.71 NPSR1 (0.52) MAPTALDH1A1MAPK1MEN1KMT2A
SCHEMBL2149849 0.70 ALDH1A1 (0.53) MAPTALDH1A1HPGDUSP2TSHR
SCHEMBL11196544 0.70 HPGD (0.69) MAPTALDH1A1HPGDMAPK1USP2
SCHEMBL6743259 0.70 ALDH1A1 (0.58) MAPTALDH1A1HPGDMEN1KMT2A

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-5019611-A Tetrahydrotriazinethiones THE GOODYEAR TIRE & RUBBER COMPANY (US) 1991-05-28 US disclosed
EP-0278890-A2 Non-staining and slightly-staining antiozonants THE GOODYEAR TIRE & RUBBER COMPANY (US) 1988-08-17 EP disclosed