SCHEMBL4712030

SCHEMBL4712030

CCCOc1cc2oc(=O)c3c(c2cc1Cl)CCCC3

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 11/20 0.77
▸ ALDH1A1 P00352 11/20 0.77
▸ FHIT P49789 1/20 0.65
▸ HSD17B10 Q99714 8/20 0.62
▸ HPGD P15428 8/20 0.62
▸ TSHR P16473 6/20 0.62
▸ MAPT P10636 5/20 0.62
▸ KMT2A Q03164 5/20 0.62
▸ MEN1 O00255 4/20 0.62
▸ GLA P06280 4/20 0.62
▸ GAA P10253 4/20 0.62
▸ CASP1 P29466 3/20 0.62
▸ LMNA P02545 2/20 0.62
▸ POLB P06746 2/20 0.62
▸ CASP7 P55210 2/20 0.62
▸ MAPK1 P28482 2/20 0.62
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ PLA2G1B P04054 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ ATG4B Q9Y4P1 1/20 0.52

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
SCHEMBL4711017 0.90 KDM4E (0.95) KDM4EALDH1A1FHITHSD17B10HPGD
SCHEMBL4708976 0.88 KDM4E (0.70) KDM4EALDH1A1FHITHSD17B10HPGD
SCHEMBL4709945 0.87 KDM4E (0.69) KDM4EALDH1A1FHITHSD17B10HPGD
SCHEMBL4712732 0.83 ALDH1A1 (0.70) KDM4EALDH1A1FHITHSD17B10HPGD
SCHEMBL4710609 0.82 FHIT (0.71) KDM4EALDH1A1FHITHSD17B10HPGD
SCHEMBL4709413 0.81 KDM4E (0.68) KDM4EALDH1A1FHITHSD17B10HPGD
SCHEMBL4709622 0.81 KDM4E (0.67) KDM4EALDH1A1FHITHSD17B10HPGD
SCHEMBL4710838 0.81 KDM4E (0.67) KDM4EALDH1A1FHITHSD17B10HPGD
SCHEMBL4710697 0.81 FHIT (0.76) KDM4EALDH1A1FHITHSD17B10HPGD
SCHEMBL4710578 0.81 KDM4E (0.63) KDM4EALDH1A1FHITHSD17B10HPGD

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-1957475-A1 CHROMENONES AND THEIR USE AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Merz Pharma GmbH & Co.KGaA (DE) 2008-08-20 — — EP disclosed
WO-2007045876-A1 CHROMENONES AND THEIR USE AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS MERZ PHARMA GMBH & CO. KGAA (DE) 2007-04-26 — — WO disclosed
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