SCHEMBL9406969

SCHEMBL9406969

CCCCC1CCC(CCC2COC(c3cc(F)c(C#N)c(F)c3)OC2)CC1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.31
TRPV4 Q9HBA0 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
SCHEMBL9406965 1.00 CYP1A2 (0.31) CYP1A2TRPV4
SCHEMBL9406788 0.96 CYP1A2 (0.30) CYP1A2
SCHEMBL9406792 0.96 CYP1A2 (0.30) CYP1A2
SCHEMBL9406803 0.95 ALDH1A1 (0.32)
SCHEMBL9406993 0.95 ALDH1A1 (0.32)
SCHEMBL9406797 0.95 ALDH1A1 (0.32)
SCHEMBL9406997 0.95 ALDH1A1 (0.32)
SCHEMBL9407023 0.95 ALDH1A1 (0.32)
SCHEMBL9859757 0.95 ALDH1A1 (0.32)
SCHEMBL9407057 0.95 ALDH1A1 (0.32)

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