SCHEMBL7730953

SCHEMBL7730953

CCCCCC1CCC(CCc2ccc(C(F)(F)Oc3cc(F)c(OC(F)F)c(F)c3)cc2)CC1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 2/20 0.31
ITGA2B P08514 2/20 0.31
MAOB P27338 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
SCHEMBL7730946 1.00 ITGB3 (0.31) ITGB3ITGA2BMAOB
SCHEMBL7733362 0.97 HRH3 (0.31) MAOB
SCHEMBL7733369 0.97 HRH3 (0.31) MAOB
SCHEMBL7729738 0.93 MAOB (0.32) MAOB
SCHEMBL7729741 0.93 MAOB (0.32) MAOB
SCHEMBL7732279 0.91 MAOB (0.32) MAOB
SCHEMBL7732280 0.91 MAOB (0.32) MAOB
SCHEMBL7733399 0.89 PDE4D (0.33) ITGB3ITGA2B
SCHEMBL7733403 0.89 PDE4D (0.33) ITGB3ITGA2B
SCHEMBL7731369 0.89 MAOB (0.32) ITGB3ITGA2BMAOB

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