SCHEMBL10748639

SCHEMBL10748639

Cc1cc(-n2[se]c3ccccc3c2=S)nc(C)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 7/20 0.37
▸ MPI P34949 2/20 0.37
▸ PHOSPHO1 Q8TCT1 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ QSOX1 O00391 1/20 0.34
▸ RGS12 O14924 1/20 0.34
▸ PMM2 O15305 1/20 0.34
▸ PLIN1 O60240 1/20 0.34
▸ GMNN O75496 1/20 0.34
▸ BBOX1 O75936 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ CYBB P04839 1/20 0.34
▸ BCHE P06276 1/20 0.34
▸ GLA P06280 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34

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
SCHEMBL10501920 0.85 METAP2 (0.40) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL5916805 0.82 METAP2 (0.54) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL10747439 0.80 METAP2 (0.40) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL10502063 0.79 METAP2 (0.39) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL10746982 0.75 NCF1 (0.50) MPIPHOSPHO1KDM4EMEN1LMNA
SCHEMBL10501684 0.75 SMN1; SMN2 (0.45) METAP2MPIPHOSPHO1KDM4EALDH1A1
SCHEMBL10742882 0.74 HTT (0.40) METAP2MPIPHOSPHO1LMNAMAPT
SCHEMBL10501746 0.73 METAP2 (0.43) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL10501874 0.72 METAP2 (0.36) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL10502572 0.72 METAP2 (0.47) METAP2MPIPHOSPHO1KDM4EMEN1

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
US-4711961-A Benzisoselenazolethiones and process for the treatment of various diseases in humans A. NATTERMANN & CIE GMBH (DE) 1987-12-08 — — US disclosed
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