SCHEMBL5505454

SCHEMBL5505454

C=CCCCCCC.CCCCCCC1CO1

nearest known ligand 0.70

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.70
▸ TSHR P16473 2/20 0.59
▸ EPHX1 P07099 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.42
▸ ENPP2 Q13822 9/20 0.39
▸ LPAR2 Q9HBW0 6/20 0.39

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
SCHEMBL6673883 1.00 ALDH1A1 (0.70) ALDH1A1TSHREPHX1TDP1ENPP2
SCHEMBL9132384 1.00 ALDH1A1 (0.70) ALDH1A1TSHREPHX1TDP1ENPP2
SCHEMBL11522187 0.90 ALDH1A1 (0.52) ALDH1A1TSHREPHX1TDP1LPAR2
SCHEMBL143336 0.90 ALDH1A1 (0.52) ALDH1A1TSHREPHX1TDP1LPAR2
SCHEMBL1495306 0.90 ALDH1A1 (0.52) ALDH1A1TSHREPHX1TDP1LPAR2
SCHEMBL12977798 0.90 ALDH1A1 (0.52) ALDH1A1TSHREPHX1TDP1LPAR2
SCHEMBL5398476 0.90 ALDH1A1 (0.52) ALDH1A1TSHREPHX1TDP1LPAR2
SCHEMBL12977812 0.90 ALDH1A1 (0.52) ALDH1A1TSHREPHX1TDP1LPAR2
SCHEMBL4459568 0.90 ALDH1A1 (0.52) ALDH1A1TSHREPHX1TDP1LPAR2
SCHEMBL10027890 0.90 ALDH1A1 (0.52) ALDH1A1TSHREPHX1TDP1LPAR2

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
EP-1811029-A1 METHOD OF ISOLATING P450 GENE MARINE BIOTECHNOLOGY INSTITUTE CO., LTD. (JP) 2007-07-25 — — EP disclosed
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