SCHEMBL29315318

SCHEMBL29315318

CCCOCCOCCOCCOC(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
TSHR P16473 3/20 0.41
HSD17B10 Q99714 3/20 0.38
ACHE P22303 1/20 0.38
TP53 P04637 2/20 0.37
HIF1A Q16665 2/20 0.37
ABCB11 O95342 1/20 0.36
CYP3A4 P08684 1/20 0.36
ADRA2B P18089 1/20 0.36
OPRD1 P41143 1/20 0.36
SCN5A Q14524 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
THRB P10828 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPT P10636 1/20 0.36
DGKA P23743 1/20 0.34
ZDHHC7 Q9NXF8 1/20 0.34
EPHX2 P34913 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
SCHEMBL1128715 1.00 ALDH1A1 (0.41) ALDH1A1TSHRHSD17B10ACHETP53
SCHEMBL29315316 1.00 ALDH1A1 (0.41) ALDH1A1TSHRHSD17B10ACHETP53
SCHEMBL3454202 0.91 ALDH1A1 (0.42) ALDH1A1TSHRHSD17B10ACHETP53
SCHEMBL17461587 0.91 ALDH1A1 (0.42) ALDH1A1TSHRHSD17B10ACHETP53
SCHEMBL28642740 0.88 ALDH1A1 (0.41) ALDH1A1TSHRHSD17B10ACHETP53
SCHEMBL28125534 0.88 ALDH1A1 (0.46) ALDH1A1TSHRHSD17B10ACHETP53
SCHEMBL1471707 0.88 ALDH1A1 (0.46) ALDH1A1TSHRHSD17B10ACHETP53
SCHEMBL28633622 0.88 ALDH1A1 (0.41) ALDH1A1TSHRHSD17B10ACHETP53
SCHEMBL28644452 0.88 ALDH1A1 (0.41) ALDH1A1TSHRHSD17B10ACHETP53
SCHEMBL1470169 0.88 ALDH1A1 (0.46) ALDH1A1TSHRHSD17B10ACHETP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239934-A1 FUMARIC ACID DIESTER RESIN, FILM AND POLARIZING PLATE TOSOH CORPORATION (JP) 2024-07-18 US disclosed
US-20240239934-A1 FUMARIC ACID DIESTER RESIN, FILM AND POLARIZING PLATE TOSOH CORPORATION (JP) 2024-07-18 US disclosed