SCHEMBL9406986

SCHEMBL9406986

CCCCCCC[C@H]1CC[C@H]([C@H]2CO[C@H](c3cc(F)c(C#N)c(F)c3)OC2)CC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL9406916 1.00 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9406829 1.00 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9406933 1.00 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9406996 1.00 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9406987 1.00 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9406925 1.00 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9406992 1.00 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9406836 1.00 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9406919 1.00 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9407075 0.99

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-5354502-A Very large dielectric anisotropy and small birefringence SEIKO EPSON CORPORATION (JP) 1994-10-11 US disclosed
EP-0447565-A1 1,3-DIOXANE DERIVATIVE AND LIQUID-CRYSTAL COMPOSITION CONTAINING THE SAME SEIKO EPSON CORPORATION (JP) 1991-09-25 EP disclosed