SCHEMBL4709431

SCHEMBL4709431

O=c1oc2cc(Sc3ccccn3)c(Cl)cc2c2c1CCCC2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.50
▸ RXFP1 Q9HBX9 1/20 0.50
▸ ALDH1A1 P00352 8/20 0.46
▸ KDM4E B2RXH2 7/20 0.46
▸ HPGD P15428 5/20 0.45
▸ HSD17B10 Q99714 5/20 0.45
▸ GLA P06280 4/20 0.45
▸ GAA P10253 4/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ CASP1 P29466 3/20 0.45
▸ MAPT P10636 2/20 0.45
▸ MEN1 O00255 2/20 0.44
▸ FHIT P49789 1/20 0.43
▸ POLB P06746 3/20 0.43
▸ TSHR P16473 3/20 0.43
▸ CASP7 P55210 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ PDE7A Q13946 1/20 0.42

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
SCHEMBL4711745 0.79 TDP1 (0.53) TDP1RXFP1ALDH1A1KDM4EHPGD
SCHEMBL4711181 0.76 ALDH1A1 (0.55) ALDH1A1KDM4EHPGDHSD17B10GLA
SCHEMBL4710676 0.72 ALDH1A1 (0.58) ALDH1A1KDM4EHPGDHSD17B10GLA
SCHEMBL4712725 0.69 ALDH1A1 (0.54) ALDH1A1KDM4EHPGDHSD17B10GLA
SCHEMBL30465071 0.69 ALDH1A1 (0.65) RXFP1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL4710620 0.69 ALDH1A1 (0.65) RXFP1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL4714180 0.69 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDHSD17B10GLA
SCHEMBL4711123 0.67 KDM4E (0.64) TDP1RXFP1ALDH1A1KDM4EHPGD
SCHEMBL4713288 0.67 HSD17B10 (0.50) TDP1RXFP1ALDH1A1KDM4EHPGD
SCHEMBL4710623 0.67 MAOB (0.61) TDP1ALDH1A1KDM4EHPGDHSD17B10

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 5 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
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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