SCHEMBL11720482

SCHEMBL11720482

OCCC1COC(C(F)(F)F)(C(F)(F)F)O1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.34
GAA P10253 1/20 0.34
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 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
SCHEMBL11719570 0.85
SCHEMBL7079823 0.84
SCHEMBL9458718 0.76
SCHEMBL11718275 0.74
SCHEMBL11722580 0.70 EPHX1 (0.30)
SCHEMBL649656 0.69 CA2 (0.44) MAPTGAAALDH1A1KDM4E
SCHEMBL418942 0.69 CA2 (0.44) MAPTGAAALDH1A1KDM4E
SCHEMBL368709 0.69 CA2 (0.44) MAPTGAAALDH1A1KDM4E
SCHEMBL11721771 0.69 CA2 (0.33) ALDH1A1
SCHEMBL11722842 0.69

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-4060532-A Halogenated dioxolane tranquilizers ICI UNITED STATES INC. (US) 1977-11-29 US disclosed
US-3996376-A Halogenated dioxolane tranquilizers ICI UNITED STATES INC. (US) 1976-12-07 US disclosed