SCHEMBL2537579

SCHEMBL2537579

O=C(O)CC1(C2CCC3OC3C2)CCC2OC2C1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.33
KDM4E B2RXH2 1/20 0.32
GMNN O75496 1/20 0.32
LMNA P02545 1/20 0.32
PMP22 Q01453 1/20 0.32
TFPI2 P48307 1/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32
NFKB1 P19838 1/20 0.32
THPO P40225 1/20 0.32
CYP1A2 P05177 1/20 0.31
HSD11B1 P28845 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
SCHEMBL27803698 0.78 CYP19A1 (0.36) CYP19A1
SCHEMBL36696 0.76 TFPI2 (0.34) CYP19A1KDM4EGMNNLMNAPMP22
SCHEMBL16440132 0.74 CYP19A1 (0.32) CYP19A1
Bicarbonate SCHEMBL2959436 0.72 LMNA (0.38) CYP19A1KDM4EGMNNLMNAPMP22
Carbamic Acid SCHEMBL28815467 0.70 CYP19A1 (0.36) CYP19A1KDM4EGMNNLMNAPMP22
SCHEMBL8191222 0.70 CYP2C19 (0.30)
SCHEMBL11771538 0.69 CYP19A1 (0.35) CYP19A1
SCHEMBL28644478 0.68 LMNA (0.37) CYP19A1KDM4EGMNNLMNAPMP22
SCHEMBL26073683 0.68 CYP19A1 (0.34) CYP19A1
SCHEMBL15436 0.67 KDM4E (0.32) KDM4EGMNNLMNAPMP22TFPI2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8043701-B2 Polymerizable organosilicon nanocapsules EVONIK DEGUSSA GMBH (DE) 2011-10-25 US disclosed
US-20060063002-A1 Polymerizable organosilicon nanocapsules DEGUSSA AG (DE) 2006-03-23 US disclosed
US-6699586-B2 Organosilicon nano/microhybrid or microhybrid system composition for scratch and abrasion resistant coatings DEGUSSA AG (DE) 2004-03-02 US disclosed
US-6689468-B2 NANOSCALE CORE SUCH AS OF PYROGENIC SILICA, AND ORGANOSILICON SHELL DERIVED FROM TRIALKOXYALKYLSILANES; SCRATCH RESISTANT COATINGS; CAPSULE WITH A LIQUID, CURABLE SYNTHETIC RESIN OR PREPOLYMER FOR LOW VISCOSITY, SOLVENT-FREE COATINGS DEGUSSA AG (DE) 2004-02-10 US disclosed
US-20020197475-A1 Organosilicon nano/microhybrid or microhybrid system composition for scratch and abrasion resistant coatings DEGUSSA AG (DE) 2002-12-26 US disclosed
US-20020098243-A1 For use in scratch resistant coatings for automobiles; comprises organosilicon compound/polymer shell and metal oxide core which are covalently attached DEGUSSA AG (DE) 2002-07-25 US disclosed
US-20020094439-A1 Organosilicon nanocapsules EVONIK DEGUSSA GMBH (DE) 2002-07-18 US disclosed