SCHEMBL7415224

SCHEMBL7415224

CC(C)(C)OC(=O)COc1cccc(OCCO)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
PLA2G4B P0C869 3/20 0.45
MAPT P10636 2/20 0.45
POLB P06746 1/20 0.45
CYP2C9 P11712 1/20 0.45
HPGD P15428 1/20 0.45
CYP2C19 P33261 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
NR1H2 P55055 1/20 0.44
PSEN1 P49768 2/20 0.44
PSEN2 P49810 2/20 0.44
APH1B Q8WW43 2/20 0.44
NCSTN Q92542 2/20 0.44
APH1A Q96BI3 2/20 0.44
PSENEN Q9NZ42 2/20 0.44
ALDH1A1 P00352 1/20 0.43
RECQL P46063 1/20 0.43
PTPN1 P18031 1/20 0.43
GAA P10253 2/20 0.43
MTNR1A P48039 1/20 0.40

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
SCHEMBL17024452 0.91 LMNA (0.53) LMNAPLA2G4BMAPTPOLBCYP2C9
SCHEMBL30737444 0.83 LMNA (0.50) LMNAMAPTPOLBCYP2C9HPGD
SCHEMBL7421105 0.83 CYP4F2 (0.52) LMNAPLA2G4BMAPTPOLBCYP2C9
SCHEMBL6216172 0.82 TSHR (0.49) LMNAPLA2G4BMAPTPOLBCYP2C9
SCHEMBL29642028 0.82 TSHR (0.49) LMNAPLA2G4BMAPTPOLBCYP2C9
SCHEMBL7385040 0.82 GAA (0.62) LMNAMAPTPOLBHPGDALDH1A1
SCHEMBL7415227 0.81 LMNA (0.44) LMNAMAPTPOLBCYP2C9HPGD
SCHEMBL7110156 0.81 PPARA (0.55) PLA2G4BNR1H2PSEN1PSEN2APH1B
SCHEMBL7110609 0.81 HSD17B10 (0.52) LMNAMAPTCYP2C19PSEN1PSEN2
SCHEMBL2838476 0.81 CYP3A4 (0.51) LMNAMAPTPOLBCYP2C9HPGD

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
US-7220773-B2 Heterocylic amines used as antidiabetic or hyperglycemic agents DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-05-22 US disclosed
EP-1173415-A1 DIPHENYLUREA DERIVATIVES AstraZeneca AB (SE) 2002-01-23 EP disclosed
WO-2000064866-A1 DIPHENYLUREA DERIVATIVES ASTRAZENECA AB (SE) 2000-11-02 WO disclosed