SCHEMBL9614458

SCHEMBL9614458

CCOC(=O)c1ccccc1/N=N/c1ccc(O)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDE P14735 1/20 0.61
TSHR P16473 1/20 0.56
MAPT P10636 6/20 0.55
SMN1; SMN2 Q16637 6/20 0.55
L3MBTL1 Q9Y468 6/20 0.55
MAPK1 P28482 5/20 0.55
LMNA P02545 4/20 0.55
TP53 P04637 3/20 0.55
ALDH1A1 P00352 2/20 0.55
ACHE P22303 1/20 0.51
HTT P42858 5/20 0.50
TDP1 Q9NUW8 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
GAA P10253 1/20 0.50
POLB P06746 2/20 0.49
RAB9A P51151 1/20 0.49
HSD17B10 Q99714 1/20 0.49
CA12 O43570 3/20 0.49
CA1 P00915 3/20 0.49

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
SCHEMBL9328655 1.00 IDE (0.61) IDETSHRMAPTSMN1; SMN2L3MBTL1
SCHEMBL28548771 0.90 TSHR (0.61) IDETSHRMAPTSMN1; SMN2L3MBTL1
SCHEMBL18874951 0.79 IDE (0.73) IDEMAPTSMN1; SMN2L3MBTL1MAPK1
SCHEMBL10025042 0.79 ESR1 (0.79) TSHRMAPTSMN1; SMN2MAPK1LMNA
SCHEMBL31218179 0.79 ESR1 (0.79) TSHRMAPTSMN1; SMN2MAPK1LMNA
SCHEMBL439436 0.77 TSHR (0.65) TSHRMAPTL3MBTL1MAPK1LMNA
SCHEMBL7992543 0.77 TSHR (0.69) TSHRMAPTL3MBTL1MAPK1LMNA
SCHEMBL453284 0.77 IDE (1.00) IDEMAPTL3MBTL1MAPK1ALDH1A1
SCHEMBL29401042 0.77 IDE (1.00) IDEMAPTL3MBTL1MAPK1ALDH1A1
SCHEMBL12100493 0.77 IDE (1.00) IDEMAPTL3MBTL1MAPK1ALDH1A1

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
EP-0465577-A1 CATALYZED REPORTER DEPOSITION. DU PONT (US) 1992-01-15 EP disclosed
WO-1990011523-A2 CATALYZED REPORTER DEPOSITION E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-10-04 WO disclosed