SCHEMBL9468404

SCHEMBL9468404

C=C(C(=O)OCCCCCCCCCCCC)C1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
NAAA Q02083 6/20 0.46
EPHX1 P07099 1/20 0.45
EPHX2 P34913 1/20 0.42
GAA P10253 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RAD52 P43351 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL9009691 0.94 TSHR (0.46) TSHRNAAAEPHX1EPHX2
SCHEMBL29117601 0.94 TSHR (0.46) TSHRNAAAEPHX1EPHX2
SCHEMBL14913823 0.92 TSHR (0.61) TSHRNAAAEPHX1GAAMAPK1
SCHEMBL28345139 0.88 TSHR (0.61) TSHRNAAAEPHX1EPHX2GAA
SCHEMBL29117580 0.87 ALDH1A1 (0.39) TSHRNAAAEPHX1
SCHEMBL27547851 0.87 ALDH1A1 (0.39) TSHRNAAAEPHX1
SCHEMBL14916019 0.85 TSHR (0.50) TSHRNAAAEPHX1GAAMAPK1
SCHEMBL27980846 0.85 TSHR (0.38) TSHRNAAAEPHX1
SCHEMBL10010171 0.84 TSHR (0.50) TSHRNAAAEPHX1EPHX2RAD52
SCHEMBL10011297 0.84 TSHR (0.50) TSHRNAAAEPHX1EPHX2RAD52

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-5242972-A Acidic fluoropolymer is reacted with epoxysilane, weather resistant films KANSAI PAINT CO., LTD. (JP) 1993-09-07 US disclosed