SCHEMBL29575655

SCHEMBL29575655

Oc1ccc2ccccc2c1C1OCCS1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
NPSR1 Q6W5P4 3/20 0.48
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
HTT P42858 2/20 0.48
LMNA P02545 2/20 0.48
HSP90AA1 P07900 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
KDM4E B2RXH2 5/20 0.44
ALDH1A1 P00352 3/20 0.42
POLB P06746 2/20 0.42
GAA P10253 2/20 0.42
PTPN22 Q9Y2R2 1/20 0.42
MECP2 P51608 1/20 0.41
MBD2 Q9UBB5 1/20 0.41
THRB P10828 1/20 0.39
HIF1A Q16665 1/20 0.39
CYP1A2 P05177 2/20 0.39
USP2 O75604 1/20 0.39
PAK1 Q13153 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
SCHEMBL2771455 0.75 KDM4E (0.50) MAPTNPSR1KMT2AMEN1HTT
SCHEMBL11129658 0.71 MECP2 (0.49) MAPTNPSR1KMT2AMEN1HTT
SCHEMBL11796156 0.69 MEN1 (0.40) MAPTNPSR1KMT2AMEN1LMNA
SCHEMBL6399247 0.69 KDM4E (0.47) MAPTNPSR1KMT2AMEN1HTT
SCHEMBL6396905 0.68 ALDH1A1 (0.53) MAPTNPSR1KMT2AMEN1HTT
SCHEMBL18469270 0.68 ALDH1A1 (0.45) MAPTNPSR1KMT2AMEN1HTT
Hydrochloric Acid SCHEMBL11619931 0.68 PTPN22 (0.44) MAPTNPSR1KMT2AMEN1HTT
SCHEMBL6406321 0.67 ALDH1A1 (0.55) MAPTNPSR1KMT2AMEN1HTT
SCHEMBL6401067 0.67 KDM4E (0.45) MAPTNPSR1KMT2AMEN1HTT
Oxirane SCHEMBL27685885 0.65 PTPN22 (0.79) MAPTKMT2AMEN1HTTLMNA

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
CN-110129031-B Fluorescent probe for detecting hypochlorite ions and preparation method and application thereof 广东工业大学 2022-04-08 CN disclosed