SCHEMBL7306269

SCHEMBL7306269

CCOC(=O)[C@H]1NCCC1=S

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.34
GAA P10253 2/20 0.34
LMNA P02545 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PKM P14618 1/20 0.34
HTT P42858 1/20 0.33
POLB P06746 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
SCHEMBL6353034 0.81 MAPT (0.38) MAPTGAAKDM4EMEN1ALDH1A1
SCHEMBL27677514 0.77 MAPT (0.33) MAPTGAAKDM4EMEN1ALDH1A1
SCHEMBL23002174 0.75 CYP2D6 (0.38) MAPTGAAKDM4EMEN1ALDH1A1
SCHEMBL10831751 0.72 L3MBTL1 (0.39) MAPTGAALMNAKDM4EMEN1
SCHEMBL4147833 0.72 MAPT (0.33) MAPTGAAKDM4EMEN1ALDH1A1
SCHEMBL26471684 0.72 ESR2 (0.34) MAPTGAALMNAKDM4EMEN1
SCHEMBL23119015 0.72 TSHR (0.60) MAPT
SCHEMBL4853532 0.72 TSHR (0.60) MAPT
Hydrochloric Acid SCHEMBL2790413 0.71 TSHR (0.62) MAPTGAAPKM
Hydrochloric Acid SCHEMBL19953531 0.71 TSHR (0.62) MAPTGAAPKM

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
EP-0372484-A2 Condensed benzene derivative ZERIA PHARMACEUTICAL CO., LTD. (JP) 1990-06-13 EP disclosed