SCHEMBL8213797

SCHEMBL8213797

CC(=S)OCCCCCCCCCC(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.36
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA9 Q16790 3/20 0.36
ALOX15 P16050 1/20 0.33
TSHR P16473 2/20 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
SCHEMBL8211739 1.00 CA12 (0.36) CA12CA1CA2CA9ALOX15
SCHEMBL8213850 1.00 CA12 (0.36) CA12CA1CA2CA9ALOX15
SCHEMBL8211729 1.00 CA12 (0.36) CA12CA1CA2CA9ALOX15
SCHEMBL8215194 1.00 CA12 (0.36) CA12CA1CA2CA9ALOX15
SCHEMBL2021074 0.91 CA12 (0.32) CA12CA1CA2CA9
SCHEMBL8213872 0.86 CA12 (0.33) CA12CA1CA2CA9
SCHEMBL8211928 0.86 CA12 (0.33) CA12CA1CA2CA9
SCHEMBL8211985 0.83 CA12 (0.32) CA12CA1CA2CA9
SCHEMBL8205959 0.83 CA12 (0.32) CA12CA1CA2CA9
SCHEMBL2020447 0.81 SLC13A3 (0.31)

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-6153322-A Methods for making fluorinated surface modifying agents, methods of using same and products made using same HOUSTON, UNIVERSITY OF 2000-11-28 US disclosed
WO-1998040169-A1 METHODS FOR MAKING FLUORINATED SURFACE MODIFYING AGENTS, METHODS OF USING SAME AND PRODUCTS MADE USING SAME THE UNIVERSITY OF HOUSTON (US) 1998-09-17 WO disclosed