SCHEMBL7839006

SCHEMBL7839006

[CH2]C(C)OCC(C)OCCC

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.42
HSD17B10 Q99714 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
SCHEMBL7836491 0.98 TDP1 (0.45) TDP1HSD17B10
SCHEMBL7837154 0.86 TDP1 (0.35) TDP1
SCHEMBL7839380 0.85 DNM1 (0.39) TDP1
SCHEMBL7838540 0.85 TDP1 (0.38) TDP1
SCHEMBL7838795 0.83 DNM1 (0.42) TDP1
SCHEMBL7836293 0.83 DNM1 (0.42) TDP1
SCHEMBL7836335 0.83 DNM1 (0.42) TDP1
SCHEMBL7837049 0.83 DNM1 (0.38) TDP1
SCHEMBL7839001 0.83 DNM1 (0.42) TDP1
SCHEMBL7839444 0.83 DNM1 (0.42) TDP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0751133-B1 Pyrimidine compound, and liquid crystal composition and liquid crystal element using the same MITSUI CHEMICALS INC (JP) 2001-09-12 EP disclosed
US-5770108-A HIGH SPEED RESPONSE, MOLECULAR ORIENTATION, HIGH CONTRAST, RECEPTIVITY MITSUI TOATSU CHEMICALS, INC. (JP) 1998-06-23 US disclosed
EP-0751133-A1 Pyrimidine compound, and liquid crystal composition and liquid crystal element using the same MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1997-01-02 EP disclosed