SCHEMBL17970190

SCHEMBL17970190

CCCNC(=O)c1ccc2c(c1)C(=O)OC21c2ccc(OC(C)=O)cc2Oc2cc(OC(C)=O)ccc21

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.66
▸ MEN1 O00255 2/20 0.66
▸ MAPT P10636 2/20 0.66
▸ HTT P42858 2/20 0.66
▸ USP2 O75604 1/20 0.66
▸ ALDH1A1 P00352 1/20 0.66
▸ LMNA P02545 1/20 0.66
▸ GSTP1 P09211 1/20 0.64
▸ CYP3A4 P08684 1/20 0.50
▸ FTO Q9C0B1 6/20 0.45
▸ KCNH2 Q12809 3/20 0.42
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ ITPR3 Q14573 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ ALB P02768 1/20 0.40
▸ HPGD P15428 2/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ RECQL P46063 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
SCHEMBL22434379 0.92 MEN1 (0.62) KMT2AMEN1MAPTHTTUSP2
SCHEMBL18677730 0.85 MAPT (0.77) KMT2AMEN1MAPTHTTUSP2
SCHEMBL29388062 0.85 MEN1 (0.59) KMT2AMEN1MAPTHTTUSP2
SCHEMBL31343967 0.85 GSTP1 (0.58) KMT2AMEN1MAPTHTTUSP2
SCHEMBL22434464 0.85 MEN1 (0.54) KMT2AMEN1MAPTHTTUSP2
SCHEMBL17956704 0.85 FTO (0.60) KMT2AMEN1MAPTHTTUSP2
SCHEMBL6663204 0.84 MEN1 (0.75) KMT2AMEN1MAPTHTTUSP2
SCHEMBL29485015 0.84 MEN1 (0.75) KMT2AMEN1MAPTHTTUSP2
SCHEMBL29663660 0.84 MEN1 (0.75) KMT2AMEN1MAPTHTTUSP2
SCHEMBL17970189 0.84 MAPT (0.66) KMT2AMEN1MAPTHTTUSP2

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
EP-3050886-A1 Fluorescent dyes and dye precursors Bürkert Werke GmbH (DE) 2016-08-03 — — EP disclosed
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