SCHEMBL4248554

SCHEMBL4248554

C=Cc1ccc(CC(CCCO)OC(CCCO)Cc2ccc(C=C)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL10700065 0.83 ALDH1A1 (0.34) ALDH1A1
SCHEMBL8196547 0.77 ALDH1A1 (0.35) ALDH1A1
SCHEMBL3474952 0.76 ALDH1A1 (0.41) ALDH1A1TAS1R3TAS1R1
SCHEMBL29268616 0.73 ALDH1A1 (0.38) ALDH1A1TAS1R3TAS1R1TDP1
SCHEMBL2773876 0.72 ALDH1A1 (0.37) ALDH1A1
SCHEMBL2275914 0.72 ALDH1A1 (0.37) ALDH1A1
1,4-Butanediol SCHEMBL28161536 0.72 ALDH1A1 (0.61) ALDH1A1TAS1R3TAS1R1TDP1
SCHEMBL27555588 0.72 ALDH1A1 (0.44) ALDH1A1TAS1R3TAS1R1TDP1
SCHEMBL3627943 0.71 ALDH1A1 (0.48) ALDH1A1TDP1
SCHEMBL24146430 0.70 ALDH1A1 (0.52) ALDH1A1TAS1R3TAS1R1TDP1

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-7569644-B2 Paint composition, process for producing transparent protective film using the same, and organic glass provided with transparent protective film KABUSHIKI KAISHA TOYOTA JIDOSHOKKI (JP) 2009-08-04 US disclosed
US-20050182226-A1 Paint composition, process for producing transparent protective film using the same, and organic glass provided with transparent protective film KABUSHIKI KAISHA TOYOTA JIDOSHOKKI (JP) 2005-08-18 US disclosed