SCHEMBL28918901

SCHEMBL28918901

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

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.31
GRIK1 P39086 2/20 0.30
GRIA2 P42262 2/20 0.30
GRIA4 P48058 2/20 0.30
GRIK3 Q13003 2/20 0.30
GRIK5 Q16478 2/20 0.30
GRIA1 P42261 1/20 0.30
GRIK2 Q13002 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
BLM P54132 1/20 0.30
SLC6A3 Q01959 1/20 0.30
MEN1 O00255 1/20 0.30
CYP2D6 P10635 1/20 0.30
NFKB1 P19838 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 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
SCHEMBL28770365 0.85 TSHR (0.39) TSHRKDM4EALDH1A1GRIK1GRIA2
SCHEMBL11746179 0.78 TSHR (0.42) TSHRKDM4EGRIK1GRIA2GRIA4
SCHEMBL28632247 0.77 TSHR (0.41) TSHRKDM4EALDH1A1
SCHEMBL8505529 0.75 TSHR (0.46) TSHRKDM4EALDH1A1
SCHEMBL8505523 0.75 TSHR (0.46) TSHRKDM4EALDH1A1
SCHEMBL6450401 0.73 KDM4E (0.45) TSHRKDM4EGRIK1GRIA2GRIA4
SCHEMBL11752118 0.73 KDM4E (0.45) TSHRKDM4EGRIK1GRIA2GRIA4
SCHEMBL28636721 0.73 TSHR (0.51) TSHRKDM4EALDH1A1
SCHEMBL28770373 0.73 KDM4E (0.41) TSHRKDM4EGRIK1GRIA2GRIA4
SCHEMBL11748378 0.72 KDM4E (0.43) TSHRKDM4EALDH1A1GRIK1GRIA2

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-115185156-A Photosensitive resin composition for forming partition wall, organic electroluminescent element, image display device, and illumination 三菱化学株式会社 2022-10-14 CN disclosed