SCHEMBL9719196

SCHEMBL9719196

CCC(O)C(CC)OC(=O)/C=C/C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 10/20 0.52
TSHR P16473 2/20 0.33
TP53 P04637 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
EGLN3 Q9H6Z9 1/20 0.33
ALDH1A1 P00352 3/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ACHE P22303 1/20 0.32
BACE1 P56817 1/20 0.32
GAA P10253 1/20 0.31
ATM Q13315 1/20 0.31

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
SCHEMBL9347791 1.00 HCAR2 (0.52) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL11128184 0.88 HCAR2 (0.47) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL9773642 0.85 HCAR2 (0.57) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL9576299 0.85 HCAR2 (0.57) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL9576188 0.85 HCAR2 (0.47) HCAR2TSHRACHEBACE1ATM
SCHEMBL6448412 0.83 HCAR2 (0.59) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL11746166 0.83 HCAR2 (0.59) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL6448405 0.83 HCAR2 (0.59) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL9773737 0.80 HCAR2 (0.55) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL11128179 0.79 HCAR2 (0.35) HCAR2TSHRTDP1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5142009-A Crosslinked blend of fumaric acid diesters TOMEI SANGYO KABUSHIKI KAISHA (JP) 1992-08-25 US disclosed
US-4868260-A OXYGEN PERMEABILITY TOMEI SANGYO KABUSHIKI KAISHA (JP) 1989-09-19 US disclosed
EP-0219884-A2 Hard contact lens material Tomei Sangyo Kabushiki Kaisha (JP) 1987-04-29 EP disclosed