SCHEMBL10748075

SCHEMBL10748075

COc1ccc2c(=S)n(-c3ncccn3)[se]c2c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ KMT2A Q03164 3/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ KDM4E B2RXH2 4/20 0.38
▸ METAP2 P50579 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPK1 P28482 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ CLK4 Q9HAZ1 2/20 0.36
▸ DYRK1A Q13627 2/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.35
▸ DRD2 P14416 1/20 0.35
▸ DRD4 P21917 1/20 0.35
▸ DRD3 P35462 1/20 0.35
▸ MAOA P21397 1/20 0.35

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
SCHEMBL10746448 0.89 TXNRD1 (0.43) MAPTNPC1KMT2ARAB9AKDM4E
SCHEMBL10502051 0.86 SLC11A2 (0.40) MAPTKDM4EMETAP2ALDH1A1
SCHEMBL10746470 0.83 METAP2 (0.52) MAPTKMT2AKDM4EMETAP2ALDH1A1
SCHEMBL11020733 0.82 METAP2 (0.38) MAPTNPC1KMT2ARAB9AKDM4E
SCHEMBL10747716 0.81 MPI (0.35) RAB9AMETAP2ALDH1A1RXFP1
SCHEMBL10501830 0.81 METAP2 (0.48) MAPTKMT2AKDM4EMETAP2ALDH1A1
SCHEMBL10501622 0.79 RAB9A (0.43) MAPTNPC1KMT2ARAB9AKDM4E
SCHEMBL10745189 0.78 ALDH1A1 (0.34) KMT2AKDM4EMETAP2ALDH1A1MEN1
SCHEMBL10747300 0.78 NR4A2 (0.33) KMT2AMETAP2ALDH1A1MEN1PKM
SCHEMBL10501980 0.77 METAP2 (0.41) MAPTKDM4EMETAP2ALDH1A1

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-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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