SCHEMBL13779554

SCHEMBL13779554

CCC(C)(C)C(=O)OCCCCC(=O)OC1(C)CCCC1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.35
EPHX2 P34913 3/20 0.32
DGKA P23743 1/20 0.32
FKBP1A P62942 1/20 0.31
PRKCA P17252 2/20 0.30
PRSS1 P07477 1/20 0.30
PRSS2 P07478 1/20 0.30
PRSS3 P35030 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
SCHEMBL12885013 0.96 CYP19A1 (0.35) CYP19A1FKBP1A
SCHEMBL47437 0.90 CYP19A1 (0.37) CYP19A1
SCHEMBL47455 0.89 CYP19A1 (0.39) CYP19A1
SCHEMBL16904886 0.88 CYP19A1 (0.35) CYP19A1DGKA
SCHEMBL16904905 0.86 CYP19A1 (0.37) CYP19A1DGKA
SCHEMBL16904893 0.86 CYP19A1 (0.37) CYP19A1DGKA
SCHEMBL47550 0.81 CYP19A1 (0.38) CYP19A1
SCHEMBL14984088 0.81 CYP19A1 (0.35) CYP19A1
SCHEMBL12216106 0.81 HMGCR (0.31) FKBP1A
SCHEMBL3434644 0.80 CYP19A1 (0.40) CYP19A1

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
US-7556908-B2 Chemically amplified positive resist composition, (meth)acrylate derivative and a process for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-07-07 US disclosed
US-7232642-B2 Chemically amplified positive resist composition, a haloester derivative and a process for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-06-19 US disclosed