SCHEMBL30818521

SCHEMBL30818521

CCCCCCCCCCCCCCCCCOS(=O)(=O)CCCCCCCCF

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 12/20 0.50
CA1 P00915 10/20 0.50
CA9 Q16790 8/20 0.50
CA12 O43570 3/20 0.50
CA7 P43166 3/20 0.50
CA14 Q9ULX7 3/20 0.50
CA3 P07451 2/20 0.50
CA4 P22748 2/20 0.50
CA6 P23280 2/20 0.50
CA5A P35218 2/20 0.50
CA5B Q9Y2D0 2/20 0.50
RECQL P46063 2/20 0.48
GLA P06280 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
EPHX2 P34913 1/20 0.48
BLM P54132 1/20 0.48
FAAH O00519 2/20 0.45
PRKCA P17252 1/20 0.38

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
SCHEMBL29166803 1.00 CA2 (0.50) CA2CA1CA9CA12CA7
SCHEMBL30818531 1.00 CA2 (0.50) CA2CA1CA9CA12CA7
SCHEMBL30818545 1.00 CA2 (0.50) CA2CA1CA9CA12CA7
SCHEMBL28630171 1.00 CA2 (0.50) CA2CA1CA9CA12CA7
SCHEMBL30818478 1.00 CA2 (0.50) CA2CA1CA9CA12CA7
SCHEMBL30818560 1.00 CA2 (0.50) CA2CA1CA9CA12CA7
SCHEMBL29166883 1.00 CA2 (0.50) CA2CA1CA9CA12CA7
SCHEMBL30818527 1.00 CA2 (0.50) CA2CA1CA9CA12CA7
SCHEMBL29222892 1.00 CA2 (0.50) CA2CA1CA9CA12CA7
SCHEMBL30818494 1.00 CA2 (0.50) CA2CA1CA9CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107209146-B Electrochemical gas sensor and electrolyte for electrochemical gas sensor 德尔格安全股份两合公司 2024-03-12 CN disclosed