SCHEMBL4712245

SCHEMBL4712245

CC(C)Oc1ccc2c3c(c(=O)oc2c1NC(=S)Nc1ccc(Cl)cc1Cl)CCCC3

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.44
ALDH1A1 P00352 6/20 0.44
HSD17B10 Q99714 5/20 0.44
HPGD P15428 5/20 0.44
TSHR P16473 4/20 0.44
POLB P06746 1/20 0.44
MAPK1 P28482 2/20 0.43
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
GBA1 P04062 1/20 0.40
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PKM P14618 1/20 0.39
FHIT P49789 5/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
NPC1 O15118 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
LMNA P02545 1/20 0.37

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
SCHEMBL4709598 0.77 HSD17B10 (0.53) KDM4EALDH1A1HSD17B10HPGDTSHR
SCHEMBL4711734 0.75 HSD17B10 (0.55) KDM4EALDH1A1HSD17B10HPGDTSHR
SCHEMBL4758483 0.73 HSD17B10 (0.51) KDM4EALDH1A1HSD17B10HPGDTSHR
SCHEMBL4759771 0.72 HSD17B10 (0.51) KDM4EALDH1A1HSD17B10HPGDTSHR
SCHEMBL4711135 0.70 HSD17B10 (0.58) KDM4EALDH1A1HSD17B10HPGDTSHR
SCHEMBL4708647 0.68 KDM4E (0.49) KDM4EALDH1A1HSD17B10HPGDTSHR
SCHEMBL8243917 0.67 HSD17B10 (0.55) KDM4EALDH1A1HSD17B10HPGDTSHR
SCHEMBL4712205 0.66 HSD17B10 (0.54) KDM4EALDH1A1HSD17B10HPGDTSHR
SCHEMBL4712785 0.66 HSD17B10 (0.59) KDM4EALDH1A1HSD17B10HPGDTSHR
SCHEMBL4708926 0.66 KDM4E (0.44) KDM4EALDH1A1HSD17B10HPGDTSHR

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