SCHEMBL24570976

SCHEMBL24570976

O=S(=O)(OCCCCCCC(F)(F)F)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 17/20 0.38
CA1 P00915 16/20 0.38
CA9 Q16790 14/20 0.38
CA12 O43570 5/20 0.38
CA7 P43166 5/20 0.38
CA14 Q9ULX7 5/20 0.38
CA3 P07451 4/20 0.38
CA4 P22748 4/20 0.38
CA6 P23280 4/20 0.38
CA5A P35218 4/20 0.38
CA5B Q9Y2D0 4/20 0.38
TSHR P16473 2/20 0.34
KDM4E B2RXH2 1/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
MMP9 P14780 1/20 0.34
ALOX15 P16050 1/20 0.34
RECQL P46063 2/20 0.31
GLA P06280 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
SCHEMBL15608435 0.91 CA2 (0.40) CA2CA1CA9CA12CA7
SCHEMBL8398329 0.89 CA2 (0.46) CA2CA1CA9CA12CA7
SCHEMBL4952312 0.89 CA2 (0.46) CA2CA1CA9CA12CA7
SCHEMBL23291930 0.89 CA2 (0.46) CA2CA1CA9CA12CA7
SCHEMBL14779178 0.89 CA2 (0.46) CA2CA1CA9CA12CA7
SCHEMBL2735589 0.89 CA2 (0.46) CA2CA1CA9CA12CA7
SCHEMBL575713 0.87 CA2 (0.44) CA2CA1CA9CA12CA7
SCHEMBL780399 0.82 CA2 (0.42) CA2CA1CA9
SCHEMBL576009 0.82 CA2 (0.44) CA2CA1CA9CA12CA7
SCHEMBL1744340 0.79 CA1 (0.55) 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
US-20220204444-A1 METHOD OF MANUFACTURING FLUORINE-CONTAINING COMPOUND AGC Inc. (JP) 2022-06-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220204444-A1 METHOD OF MANUFACTURING FLUORINE-CONTAINING COMPOUND AFF2, AFF4, AFF1 CA2 521/4885CA1 317/4885CA9 94/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.