SCHEMBL4711734

SCHEMBL4711734

CNc1c(OC(C)C)ccc2c3c(c(=O)oc12)CCCC3

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 7/20 0.55
▸ TSHR P16473 5/20 0.55
▸ MAPK1 P28482 3/20 0.55
▸ ALDH1A1 P00352 9/20 0.51
▸ KDM4E B2RXH2 8/20 0.51
▸ GBA1 P04062 1/20 0.51
▸ HPGD P15428 7/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ MAPT P10636 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ FHIT P49789 5/20 0.47
▸ MAOB P27338 2/20 0.47
▸ MAOA P21397 2/20 0.47
▸ POLB P06746 2/20 0.47
▸ GLA P06280 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ CASP1 P29466 1/20 0.47
▸ CASP7 P55210 1/20 0.47

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
SCHEMBL4759771 0.86 HSD17B10 (0.51) HSD17B10TSHRMAPK1ALDH1A1KDM4E
SCHEMBL4711135 0.83 HSD17B10 (0.58) HSD17B10TSHRMAPK1ALDH1A1KDM4E
SCHEMBL4709598 0.82 HSD17B10 (0.53) HSD17B10TSHRMAPK1ALDH1A1KDM4E
SCHEMBL4758483 0.81 HSD17B10 (0.51) HSD17B10TSHRMAPK1ALDH1A1KDM4E
SCHEMBL8243917 0.80 HSD17B10 (0.55) HSD17B10TSHRMAPK1ALDH1A1KDM4E
SCHEMBL4712205 0.79 HSD17B10 (0.54) HSD17B10TSHRMAPK1ALDH1A1KDM4E
SCHEMBL4712785 0.76 HSD17B10 (0.59) HSD17B10TSHRMAPK1ALDH1A1KDM4E
SCHEMBL4712245 0.75 KDM4E (0.44) HSD17B10TSHRMAPK1ALDH1A1KDM4E
SCHEMBL4714112 0.72 ALDH1A1 (0.66) HSD17B10TSHRMAPK1ALDH1A1KDM4E
SCHEMBL4390839 0.70 ALDH1A1 (0.78) HSD17B10TSHRMAPK1ALDH1A1KDM4E

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
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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