SCHEMBL8925515

SCHEMBL8925515

CCCCCCCCc1ccc(NC(=O)C2(N)C=CC(c3ccccc3)=CC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 17/20 0.52
THRA P10827 3/20 0.46
THRB P10828 3/20 0.46

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
SCHEMBL1955708 0.72 THRA (0.66) SPHK1THRATHRB
SCHEMBL1955611 0.72 THRA (0.66) SPHK1THRATHRB
SCHEMBL28938811 0.72 THRA (0.66) SPHK1THRATHRB
SCHEMBL1955162 0.72 THRA (0.66) SPHK1THRATHRB
SCHEMBL1955413 0.72 THRA (0.66) SPHK1THRATHRB
SCHEMBL28938795 0.72 THRA (0.66) SPHK1THRATHRB
SCHEMBL5167331 0.72 THRA (0.66) SPHK1THRATHRB
SCHEMBL7759309 0.72 THRA (0.66) SPHK1THRATHRB
SCHEMBL1953697 0.72 THRA (0.66) SPHK1THRATHRB
SCHEMBL8925508 0.72 SPHK1 (0.48) SPHK1THRATHRB

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-5659039-A YELLOW ORANGE DICHROIC DYES FOR POLARIZING FILMS FOR LIQUID CRYSTAL DISPLAYS MITSUI TOATSU CHEMICALS, INC. (JP) 1997-08-19 US disclosed