SCHEMBL8997470

SCHEMBL8997470

CC(C)(CO)COC(=O)CCO

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
SERPINE1 P05121 1/20 0.32
ADRA2A P08913 1/20 0.31
ADRA1A P35348 1/20 0.31
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
VCAM1 P19320 1/20 0.30
MAPT P10636 1/20 0.30
BLM P54132 1/20 0.30

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
SCHEMBL21143363 0.91 ADRA2A (0.38) SERPINE1ADRA2AADRA1AGAAMAPT
SCHEMBL21143386 0.87 TSHR (0.41) MAPT
SCHEMBL274635 0.87 DGKA (0.42) MAPT
SCHEMBL13380218 0.86 MGAM (0.44) SERPINE1MGAMGAASIMGAM2
SCHEMBL7055063 0.86 DGKA (0.38) CYP4F2CYP4A11VCAM1
SCHEMBL21143366 0.85 DGKA (0.45) GAAMAPT
SCHEMBL29227497 0.85 DGKA (0.45) GAAMAPT
SCHEMBL8700063 0.83 EGLN1 (0.41) SERPINE1ADRA2AADRA1AVCAM1MAPT
SCHEMBL28292486 0.82 CYP4F2 (0.33) CYP4F2CYP4A11ADRA2AADRA1AMGAM
SCHEMBL15892076 0.82 SERPINE1 (0.33) SERPINE1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0508409-B1 Photocurable resin composition NIPPON PAINT CO LTD (JP) 1996-09-04 EP claimed
US-4724254-A Water dispersible binders for cationic electra-coating and method for preparation BASF FARBEN & FASERN AG (DE) 1988-02-09 US disclosed