SCHEMBL2367780

SCHEMBL2367780

C=C(CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)C(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
USP2 O75604 1/20 0.35
MAPT P10636 1/20 0.35
KDM4E B2RXH2 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL2367786 0.88 TSHR (0.35) TSHRUSP2MAPTKDM4ETDP1
SCHEMBL2542553 0.85 TSHR (0.40) TSHRUSP2MAPTKDM4ETDP1
SCHEMBL13414938 0.84 TSHR (0.36) TSHRUSP2MAPTKDM4ETDP1
SCHEMBL9545989 0.83 TSHR (0.35) TSHRUSP2MAPTKDM4ETDP1
SCHEMBL9578404 0.83 TSHR (0.35) TSHRUSP2MAPTKDM4ETDP1
SCHEMBL16174485 0.82 USP2 (0.41) TSHRUSP2MAPT
SCHEMBL3610810 0.81
SCHEMBL3979865 0.81 TSHR (0.38) TSHRUSP2MAPTKDM4ETDP1
SCHEMBL2367713 0.81 TSHR (0.43) TSHRMAPTKDM4ETDP1
SCHEMBL6053875 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8288496-B2 Contact lens and its manufacturing method NIPPON CONTACT LENS INC. (JP) 2012-10-16 US disclosed
US-20110237701-A1 CONTACT LENS AND ITS MANUFACTURING METHOD NIPPON CONTACT LENS INC. (JP) 2011-09-29 US disclosed
EP-2369370-A2 Contact lens and its manufacturing method Nippon Contact Lens Inc. (JP) 2011-09-28 EP disclosed
US-4743667-A ACRYLATED SILOXXANES, OXYGEN PERMEABLE NIPPON CONTACT LENS, INC. (JP) 1988-05-10 US disclosed
US-4602074-A SILICON CONTAINING ACRYLIC MONOMER NIPPON CONTACT LENS MANUFACTURING LTD. (JP) 1986-07-22 US disclosed