SCHEMBL7732619

SCHEMBL7732619

C/C=C\CC[C@H]1CC[C@H](c2ccc(C(F)(F)Oc3cc(F)c(F)c(F)c3)cc2)CC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 3/20 0.33
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
ESR2 Q92731 1/20 0.31
CYP2C9 P11712 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
SCHEMBL7732625 1.00 CCR2 (0.33) CCR2ALDH1A1LMNAMAPTESR2
SCHEMBL7732628 1.00 CCR2 (0.33) CCR2ALDH1A1LMNAMAPTESR2
SCHEMBL7732634 1.00 CCR2 (0.33) CCR2ALDH1A1LMNAMAPTESR2
SCHEMBL8470877 1.00 CCR2 (0.33) CCR2ALDH1A1LMNAMAPTESR2
SCHEMBL14226665 0.91
SCHEMBL7722683 0.90 CCR2 (0.33) CCR2
SCHEMBL7722687 0.90 CCR2 (0.33) CCR2
SCHEMBL8470612 0.90 CCR2 (0.33) CCR2
SCHEMBL7722689 0.90 CCR2 (0.33) CCR2
SCHEMBL7722685 0.90 CCR2 (0.33) CCR2

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
EP-0786445-B1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORP (JP) 2002-07-17 EP disclosed
EP-0786445-A1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1997-07-30 EP disclosed