SCHEMBL8601487

SCHEMBL8601487

C=CCc1cc(-c2ccc(C#CCCCC(C)F)cc2)ccc1-c1ccccn1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SQOR Q9Y6N5 1/20 0.32

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
SCHEMBL8601776 0.90 PTAFR (0.31)
SCHEMBL8597104 0.88 CYP2D6 (0.31)
SCHEMBL8602484 0.85 SQOR (0.38) SQOR
SCHEMBL8601768 0.83 CYP1A2 (0.32) SQOR
SCHEMBL8597188 0.82 PTAFR (0.34) SQOR
SCHEMBL8597749 0.80 SQOR (0.32) SQOR
SCHEMBL8602621 0.77 SQOR (0.31) SQOR
SCHEMBL8598783 0.77 TLR8 (0.31)
SCHEMBL8596601 0.77 AKR1C3 (0.32)
SCHEMBL8600956 0.76 PTAFR (0.40)

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-5779934-A FLUORINATING AN ALCOHOL DERIVATIVE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-07-14 US disclosed