SCHEMBL10501743

SCHEMBL10501743

COc1ccc(-n2[se]c3ccccc3c2=S)c(OC)c1

nearest known ligand 0.72

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 6/20 0.54
▸ MAPT P10636 2/20 0.50
▸ LMNA P02545 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ PKM P14618 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ CDK1 P06493 1/20 0.40
▸ CCNB1 P14635 1/20 0.40
▸ MMP10 P09238 1/20 0.39
▸ KDM4E B2RXH2 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
SCHEMBL10500974 0.89 METAP2 (0.54) METAP2MAPTLMNAHTTALDH1A1
SCHEMBL10501283 0.84 METAP2 (0.68) METAP2MAPTALDH1A1KMT2A
SCHEMBL10502816 0.84 METAP2 (0.76) METAP2MAPTLMNAHTTPKM
SCHEMBL10501994 0.80 POLB (0.52) METAP2MAPTHTTALDH1A1
SCHEMBL10501336 0.79 METAP2 (0.50) METAP2MAPTLMNAHTTPKM
SCHEMBL10502310 0.79 METAP2 (0.52) METAP2MAPTLMNAHTTPKM
SCHEMBL10502111 0.79 METAP2 (0.68) METAP2MAPTLMNAHTTPKM
SCHEMBL10501995 0.75 METAP2 (0.47) METAP2
SCHEMBL10501830 0.74 METAP2 (0.48) METAP2MAPTLMNAHTTPKM
SCHEMBL10503543 0.73 METAP2 (0.50) METAP2MAPTLMNAHTTPKM

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
EP-0154851-B1 BENZISOSELENAZOLETHIONES,PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL PRODUCTS CONTAINING THESE COMPOUNDS A. Nattermann & Cie. GmbH (DE) 1989-08-02 — — EP disclosed
US-4711961-A Benzisoselenazolethiones and process for the treatment of various diseases in humans A. NATTERMANN & CIE GMBH (DE) 1987-12-08 — — US disclosed
EP-0154851-A1 Benzisoselenazolethiones,process for their preparation and pharmaceutical products containing these compounds A. Nattermann & Cie. GmbH (DE) 1985-09-18 — — EP disclosed
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