SCHEMBL27917837

SCHEMBL27917837

CC(C)CCOC(=O)CCC=N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
CA1 P00915 2/20 0.37
CA12 O43570 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
ADRA2A P08913 1/20 0.35
ADRA1A P35348 1/20 0.35
ALOX15 P16050 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.34
BLM P54132 1/20 0.34
MAPK1 P28482 2/20 0.34
PKM P14618 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL27900158 0.89 CYP19A1 (0.40) CYP19A1TDP1CA1CA12CA2
SCHEMBL333015 0.82 ADRA2A (0.50) CYP19A1TDP1CA1CA12CA2
SCHEMBL1378058 0.81 TDP1 (0.51) CYP19A1TDP1CA1CA12CA2
SCHEMBL27917852 0.81 CYP19A1 (0.44) CYP19A1TDP1CA1CA12CA2
SCHEMBL4292777 0.80 CYP19A1 (0.49) CYP19A1TDP1CA1CA12CA2
SCHEMBL14672499 0.78 DGKA (0.48) CYP19A1TDP1CA1CA12CA2
SCHEMBL249563 0.78 DGKA (0.54) CYP19A1TDP1CA1CA12CA2
SCHEMBL4160276 0.76 DGKA (0.47) CYP19A1TDP1CA1CA12CA2
SCHEMBL494383 0.76 DGKA (0.57) CYP19A1TDP1CA1CA12CA2
SCHEMBL249240 0.76 DGKA (0.57) CYP19A1TDP1CA1CA12CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103080160-A Resin composition, and semiconductor device produced using resin composition SUMITOMO BAKELITE CO 2013-05-01 CN disclosed