SCHEMBL7798812

SCHEMBL7798812

CN1CCN(CCS(=O)(=O)c2ccc(N)cc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
GAA P10253 3/20 0.49
ALDH1A1 P00352 5/20 0.47
MAPK1 P28482 1/20 0.47
LOX P28300 4/20 0.46
POLB P06746 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
ADRA2C P18825 1/20 0.43
GFER P55789 1/20 0.43
PTK2B Q14289 1/20 0.43
ESR2 Q92731 1/20 0.43
USP2 O75604 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TSHR P16473 1/20 0.40

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
SCHEMBL15434577 0.85 ALDH1A1 (0.62) KMT2AMEN1ALDH1A1MAPK1
SCHEMBL56319 0.85 LOX (0.57) LMNAKMT2AMEN1GAAALDH1A1
SCHEMBL12015821 0.84 HTR6 (0.49) KMT2AMEN1GAAALDH1A1MAPK1
SCHEMBL19152592 0.84 MEN1 (0.49) KMT2AMEN1GAAALDH1A1MAPK1
SCHEMBL19152146 0.84 MEN1 (0.49) LMNAKMT2AMEN1GAAALDH1A1
SCHEMBL18390001 0.83 MEN1 (0.69) KMT2AMEN1ALDH1A1MAPK1POLB
SCHEMBL5261643 0.83 KMT2A (0.72) KMT2AMEN1GAAALDH1A1LOX
SCHEMBL7796947 0.82 ALDH1A1 (0.49) KMT2AMEN1GAAALDH1A1MAPK1
SCHEMBL20762267 0.81 POLB (0.51) LMNAKMT2AMEN1GAAALDH1A1
SCHEMBL20982133 0.80 MEN1 (0.49) KMT2AMEN1GAAALDH1A1MAPK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0888406-B1 AZO COMPOUNDS AVECIA LTD (GB) 2001-12-12 EP disclosed
US-6008331-A USEFUL AS BLACK COLORANTS FOR INK JET PRINTING INKS ZENECA LIMITED (GB) 1999-12-28 US disclosed
EP-0888406-A1 AZO COMPOUNDS ZENECA LIMITED (GB) 1999-01-07 EP disclosed
WO-1997032931-A1 AZO COMPOUNDS ZENECA LIMITED (GB) 1997-09-12 WO disclosed