SCHEMBL9157111

SCHEMBL9157111

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

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
TSHR P16473 1/20 0.34

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
SCHEMBL9157108 0.87 ALDH1A1 (0.52) ALDH1A1TSHR
SCHEMBL11716770 0.81 KMT2A (0.48) ALDH1A1TSHR
SCHEMBL7947732 0.81 KMT2A (0.48) ALDH1A1TSHR
SCHEMBL9164814 0.81 KMT2A (0.48) ALDH1A1TSHR
SCHEMBL7614751 0.79 KMT2A (0.45) ALDH1A1TSHR
SCHEMBL24800393 0.78 ALDH1A1 (0.70) ALDH1A1TSHR
SCHEMBL30432418 0.78 ALDH1A1 (0.70) ALDH1A1TSHR
SCHEMBL4684214 0.76 ALDH1A1 (0.67) ALDH1A1TSHR
SCHEMBL10636366 0.75 KDM4C (0.36) TSHR
SCHEMBL10699229 0.75

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