SCHEMBL28069158

SCHEMBL28069158

C=CC(=O)OOC(C)C1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TSHR P16473 2/20 0.36
EPHX1 P07099 3/20 0.34
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
MMP2 P08253 2/20 0.34
CA9 Q16790 2/20 0.34
NPC1 O15118 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GAA P10253 1/20 0.31
ATM Q13315 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
SCHEMBL1774088 0.81 TSHR (0.38) ALDH1A1NPSR1TSHREPHX1CA12
SCHEMBL22129735 0.79 TSHR (0.39) ALDH1A1NPSR1TSHREPHX1CA12
SCHEMBL8170444 0.76
SCHEMBL15880463 0.76 TSHR (0.32) TSHRGAA
SCHEMBL15879986 0.74 TSHR (0.31) TSHR
SCHEMBL6066260 0.72 EPHX1 (0.38) ALDH1A1NPSR1TSHREPHX1CA12
SCHEMBL8405379 0.72 EPHX1 (0.38) ALDH1A1NPSR1TSHREPHX1CA12
SCHEMBL6065974 0.72 EPHX1 (0.38) ALDH1A1NPSR1TSHREPHX1CA12
SCHEMBL22230402 0.71 TSHR (0.36) ALDH1A1NPSR1TSHR
SCHEMBL4872026 0.71 TSHR (0.40) ALDH1A1NPSR1TSHREPHX1SMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111201252-A Resin and adhesive composition 住友化学株式会社 2020-05-26 CN disclosed
CN-104927691-B Adhesive-attached resin film and optical laminate using same 住友化学株式会社 2020-04-10 CN disclosed
CN-110799616-A Adhesive composition and film with adhesive layer 住友化学株式会社 2020-02-14 CN disclosed
CN-110799867-A Optical film 住友化学株式会社 2020-02-14 CN disclosed
CN-105659333-A Conductive film and production method therefor LG化学株式会社 2016-06-08 CN disclosed