SCHEMBL31344264

SCHEMBL31344264

O=S(=O)(OCC(F)(F)F)c1cc(O)c2ccc3c(S(=O)(=O)OCC(F)(F)F)cc(S(=O)(=O)OCC(F)(F)F)c4ccc1c2c34

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.37
▸ CA2 P00918 2/20 0.37
▸ CA9 Q16790 2/20 0.37
▸ CA12 O43570 1/20 0.31
▸ CA4 P22748 1/20 0.31
▸ CA6 P23280 1/20 0.31
▸ CA5A P35218 1/20 0.31
▸ CA7 P43166 1/20 0.31
▸ CA14 Q9ULX7 1/20 0.31
▸ CA5B Q9Y2D0 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
SCHEMBL29431679 0.70 MPL (0.49) —
SCHEMBL777419 0.70 CA2 (0.45) CA1CA2CA9CA5A
SCHEMBL112192 0.70 MPL (0.49) —
SCHEMBL24175647 0.70 MPL (0.42) —
SCHEMBL8037102 0.69 ALDH1A1 (0.40) CA1CA2CA9
SCHEMBL2776938 0.69 MPL (0.47) —
SCHEMBL217202 0.69 MPL (0.47) —
SCHEMBL592364 0.69 MPL (0.47) —
SCHEMBL31344266 0.69 MPL (0.47) —
SCHEMBL667035 0.69 MPL (0.33) CA1CA2

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
WO-2025021994-A1 NEW PHOTOCLEAVABLE PYRANINE DERIVATIVES, THEIR METHOD OF PREPARATION AND THEIR USES PARIS SCIENCES ET LETTRES (FR) 2025-01-30 — — WO disclosed
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