SCHEMBL7877169

SCHEMBL7877169

COc1ccc2c(c1)oc(=O)c1c(N)scc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.58
▸ ALDH1A1 P00352 5/20 0.58
▸ MAPT P10636 4/20 0.58
▸ RAB9A P51151 3/20 0.58
▸ POLB P06746 3/20 0.58
▸ NPC1 O15118 2/20 0.58
▸ STAT1 P42224 1/20 0.58
▸ L3MBTL1 Q9Y468 2/20 0.56
▸ LMNA P02545 1/20 0.56
▸ CDC25A P30304 1/20 0.53
▸ CDC25C P30307 1/20 0.53
▸ HPGD P15428 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ GAA P10253 1/20 0.50
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ PPARG P37231 1/20 0.49
▸ NCOA2 Q15596 1/20 0.49
▸ NCOA1 Q15788 1/20 0.49
▸ NQO1 P15559 1/20 0.48

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
SCHEMBL7881982 0.89 KDM4E (0.51) KDM4EALDH1A1MAPTRAB9APOLB
SCHEMBL7885079 0.79 CDC25A (0.50) KDM4EALDH1A1MAPTRAB9APOLB
SCHEMBL29853686 0.75 KDM4E (1.00) KDM4EALDH1A1MAPTRAB9APOLB
SCHEMBL18880260 0.75 KDM4E (1.00) KDM4EALDH1A1MAPTRAB9APOLB
SCHEMBL17384081 0.74 MAPT (0.80) KDM4EALDH1A1MAPTRAB9APOLB
SCHEMBL7882176 0.74 AR (0.48) KDM4EALDH1A1MAPTRAB9ANPC1
SCHEMBL31302252 0.74 KDM4E (0.64) KDM4EALDH1A1MAPTRAB9APOLB
SCHEMBL31260245 0.73 KDM4E (0.63) KDM4EALDH1A1MAPTRAB9APOLB
SCHEMBL9747805 0.72 KDM4E (0.67) KDM4EALDH1A1MAPTRAB9APOLB
SCHEMBL12907065 0.72 MAPT (1.00) KDM4EALDH1A1MAPTRAB9APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6169087-B1 Modulators of protein tyrosine phosphatases (PTPases) NOVO NORDISK A/S (DK) 2001-01-02 — — US disclosed
EP-1017697-A1 MODULES OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK A/S (DK) 2000-07-12 — — EP disclosed
WO-1999015529-A1 MODULES OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK A/S (DK) 1999-04-01 — — WO disclosed
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