SCHEMBL8166334

SCHEMBL8166334

CCOC(=O)c1nn(-c2ccccc2)c(=O)c2c(N)scc12.Nc1scc2c(C(=O)O)nn(-c3ccccc3)c(=O)c12

nearest known ligand 0.94

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 12/20 0.94
▸ ADORA1 P30542 12/20 0.94
▸ ALDH1A1 P00352 5/20 0.94
▸ KDM4E B2RXH2 4/20 0.94
▸ ALOX12 P18054 3/20 0.94
▸ CASP1 P29466 2/20 0.94
▸ ALOX15 P16050 2/20 0.94
▸ HSD17B10 Q99714 2/20 0.94
▸ APP P05067 6/20 0.78
▸ MEN1 O00255 1/20 0.76
▸ KMT2A Q03164 1/20 0.76
▸ L3MBTL1 Q9Y468 1/20 0.76
▸ MAPK1 P28482 1/20 0.75
▸ CASP6 P55212 1/20 0.75
▸ APAF1 O14727 1/20 0.72
▸ CACNA1B Q00975 1/20 0.72
▸ APBA1 Q02410 1/20 0.72

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
SCHEMBL7885074 0.97 MAPT (1.00) MAPTADORA1ALDH1A1KDM4EALOX12
SCHEMBL8172553 0.92 ADORA1 (0.79) MAPTADORA1ALDH1A1KDM4EALOX12
SCHEMBL7877338 0.90 MAPT (0.88) MAPTADORA1ALDH1A1KDM4EALOX12
SCHEMBL16379167 0.89 MAPT (1.00) MAPTADORA1ALDH1A1KDM4EALOX12
SCHEMBL14660061 0.89 MAPT (0.88) MAPTADORA1ALDH1A1KDM4EALOX12
SCHEMBL7886231 0.88 ADORA1 (0.80) MAPTADORA1ALDH1A1KDM4EALOX12
SCHEMBL7888083 0.88 MAPT (1.00) MAPTADORA1ALDH1A1KDM4EALOX12
SCHEMBL14659972 0.88 ADORA1 (1.00) MAPTADORA1ALDH1A1KDM4EALOX12
SCHEMBL14659429 0.87 ADORA1 (0.84) MAPTADORA1ALDH1A1KDM4EALOX12
SCHEMBL1491896 0.87 MAPT (0.84) MAPTADORA1ALDH1A1KDM4EALOX12

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-1017697-A1 MODULES OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK A/S (DK) 2000-07-12 — — EP claimed
WO-1999015529-A1 MODULES OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK A/S (DK) 1999-04-01 — — WO claimed
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