SCHEMBL8467259

SCHEMBL8467259

C=C(C)C(=O)OC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.38
TSHR P16473 3/20 0.34
KDM4E B2RXH2 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ALDH1A1 P00352 1/20 0.33
USP2 O75604 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL15157568 1.00 GAA (0.38) GAATSHRKDM4ETDP1ALDH1A1
SCHEMBL9617553 0.93 GAA (0.36) GAATSHRKDM4ETDP1ALDH1A1
SCHEMBL437657 0.88 TSHR (0.34) TSHRALDH1A1
SCHEMBL1667267 0.88 TSHR (0.34) TSHRALDH1A1
SCHEMBL16504610 0.88 TSHR (0.34) TSHRALDH1A1
SCHEMBL8520641 0.88 TSHR (0.34) TSHRALDH1A1
SCHEMBL18260684 0.88 TSHR (0.34) TSHRALDH1A1
SCHEMBL17257833 0.88 ALDH1A1 (0.32) TSHRALDH1A1
SCHEMBL5488034 0.88 ALDH1A1 (0.32) TSHRALDH1A1
SCHEMBL5482072 0.88 ALDH1A1 (0.32) TSHRALDH1A1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0914169-A3 MATERIALS FOR USE IN GLAUCOMA FILTRATION DEVICES ALCON LABORATORIES, INC. (US) 2002-08-28 EP claimed
EP-0914169-A2 MATERIALS FOR USE IN GLAUCOMA FILTRATION DEVICES ALCON LABORATORIES, INC. (US) 1999-05-12 EP claimed
WO-1998053862-A2 MATERIALS FOR USE IN GLAUCOMA FILTRATION DEVICES ALCON LABORATORIES, INC. (US) 1998-12-03 WO claimed
EP-0914169-A3 MATERIALS FOR USE IN GLAUCOMA FILTRATION DEVICES ALCON LABORATORIES, INC. (US) 2002-08-28 EP disclosed
EP-0914169-A2 MATERIALS FOR USE IN GLAUCOMA FILTRATION DEVICES ALCON LABORATORIES, INC. (US) 1999-05-12 EP disclosed
WO-1998053862-A2 MATERIALS FOR USE IN GLAUCOMA FILTRATION DEVICES ALCON LABORATORIES, INC. (US) 1998-12-03 WO disclosed