SCHEMBL9157108

SCHEMBL9157108

COCCCCCC(=O)CO[PH](=O)OCC(=O)CCCCCOC

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
TSHR P16473 1/20 0.35
MAPT P10636 1/20 0.31
KMT2A Q03164 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
SCHEMBL9157111 0.87 ALDH1A1 (0.50) ALDH1A1TSHR
SCHEMBL9164807 0.81 KMT2A (0.50) ALDH1A1TSHRMAPTKMT2A
SCHEMBL11716766 0.81 KMT2A (0.50) ALDH1A1TSHRMAPTKMT2A
SCHEMBL7947728 0.81 KMT2A (0.50) ALDH1A1TSHRMAPTKMT2A
SCHEMBL24800393 0.80 ALDH1A1 (0.70) ALDH1A1TSHRMAPTKMT2A
SCHEMBL30432418 0.80 ALDH1A1 (0.70) ALDH1A1TSHRMAPTKMT2A
SCHEMBL7614748 0.79 KMT2A (0.47) ALDH1A1TSHRMAPTKMT2A
SCHEMBL31549369 0.75 ALDH1A1 (0.62) ALDH1A1TSHRMAPTKMT2A
SCHEMBL15028760 0.74 ALDH1A1 (0.61) ALDH1A1TSHRMAPTKMT2A
SCHEMBL14926327 0.74 ALDH1A1 (0.61) ALDH1A1TSHRMAPTKMT2A

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-5380709-A Prostaglandins E and anti ulcers containing same K.K. UENO SEIYAKU OYO KENKYUJO (JP) 1995-01-10 US disclosed