SCHEMBL14571997

SCHEMBL14571997

COC(=O)Oc1cccc(C(=O)OC)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.56
ACR P10323 1/20 0.56
ESR1 P03372 1/20 0.55
ESR2 Q92731 1/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
TP53 P04637 2/20 0.55
L3MBTL1 Q9Y468 1/20 0.52
TSHR P16473 1/20 0.52
LOXL2 Q9Y4K0 1/20 0.51
RAB9A P51151 4/20 0.51
NPC1 O15118 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ALDH1A1 P00352 2/20 0.51
PKM P14618 1/20 0.51
HPGD P15428 1/20 0.51
MAPK1 P28482 1/20 0.51
CYP4F2 P78329 1/20 0.50
CYP4A11 Q02928 1/20 0.50
CES2 O00748 1/20 0.50

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
SCHEMBL7870877 0.95 PRSS1 (0.57) PRSS1ACRESR1ESR2SMN1; SMN2
SCHEMBL8578449 0.87 PRSS1 (0.57) PRSS1ACRESR1ESR2SMN1; SMN2
SCHEMBL15967785 0.86 PRSS1 (0.48) PRSS1ACRESR1ESR2SMN1; SMN2
SCHEMBL5986868 0.86 RAB9A (0.60) PRSS1ACRESR1ESR2SMN1; SMN2
SCHEMBL6174966 0.86 SMN1; SMN2 (0.59) PRSS1ACRESR1ESR2SMN1; SMN2
SCHEMBL26802232 0.86 NPC1 (0.56) ESR1ESR2SMN1; SMN2TP53L3MBTL1
SCHEMBL6441336 0.86 AKR1C3 (0.58) ESR1ESR2SMN1; SMN2RAB9ANPC1
SCHEMBL25720425 0.85 ESR1 (0.52) PRSS1ACRESR1ESR2SMN1; SMN2
SCHEMBL8617157 0.84 L3MBTL1 (0.55) PRSS1ACRESR1ESR2SMN1; SMN2
SCHEMBL7752770 0.84 PRSS1 (0.66) PRSS1ACRESR1ESR2SMN1; SMN2

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
US-20070066741-A1 High glass transition temperature thermoplastic articles CITIBANK, N.A., AS COLLATERAL AGENT 2007-03-22 US disclosed