SCHEMBL4713197

SCHEMBL4713197

O=c1oc2c(CN3CCCCC3)c(O)ccc2c2c1CCCC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 1.00
GLA P06280 9/20 1.00
GAA P10253 9/20 1.00
ALDH1A1 P00352 9/20 1.00
HPGD P15428 9/20 1.00
LMNA P02545 3/20 1.00
USP2 O75604 1/20 1.00
CASP1 P29466 6/20 0.82
CASP7 P55210 6/20 0.82
HSD17B10 Q99714 6/20 0.82
TP53 P04637 1/20 0.78
POLB P06746 1/20 0.72
ERAP1 Q9NZ08 4/20 0.67
SMN1; SMN2 Q16637 1/20 0.65
KMT2A Q03164 2/20 0.61
MAOA P21397 1/20 0.56
MAPK1 P28482 1/20 0.56
MAPT P10636 2/20 0.55
MEN1 O00255 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55

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
SCHEMBL7363397 0.81 ERAP1 (0.69) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL3789883 0.75 KDM4E (0.72) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL1448400 0.72 ERAP1 (0.69) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL26876853 0.72 KDM4E (0.57) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL17615429 0.72 ERN1 (0.68) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL31454897 0.72 ALDH1A1 (0.63) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL17615420 0.72 ERN1 (0.68) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL30776767 0.72 MAPT (0.57) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL10790707 0.71 KDM4E (0.61) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL30022407 0.71 MAPT (0.59) KDM4EGLAGAAALDH1A1HPGD

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