SCHEMBL27202086

SCHEMBL27202086

NC(=O)c1ccccc1S(=O)(=O)CCC(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 4/20 0.41
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA5A P35218 2/20 0.41
CA12 O43570 2/20 0.41
CA3 P07451 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA7 P43166 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
TSHR P16473 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 3/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
F2 P00734 2/20 0.36

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
SCHEMBL1355502 0.79 CA9 (0.46) CA9CA1CA2CA5ACA12
SCHEMBL17940345 0.78 TSHR (0.46) CA9CA1CA2CA5ACA12
SCHEMBL8517082 0.76 TSHR (0.47) CA9CA1CA2CA5ACA12
SCHEMBL365842 0.76 TSHR (0.47) CA9CA1CA2CA5ACA12
SCHEMBL3916459 0.76 CA9 (0.49) CA9CA1CA2CA5ACA12
SCHEMBL28233948 0.75 TSHR (0.47) CA9CA1CA2CA5ACA12
SCHEMBL3348471 0.75 CA12 (0.50) CA9CA1CA2CA5ACA12
SCHEMBL18921204 0.75 ALDH1A1 (0.48) CA9CA1CA2CA5ATSHR
SCHEMBL30547556 0.75 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1KDM4EMAPTHPGD
SCHEMBL11336480 0.72 TSHR (0.75) CA9CA1CA2CA5ACA12

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-20240132431-A1 METHOD FOR ALKYLATING ACIDIC FUNCTIONAL GROUP CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-04-25 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-20240132431-A1 METHOD FOR ALKYLATING ACIDIC FUNCTIONAL GROUP MGMT, MCL1, FANCF CA9 98/4885CA1 76/4885CA2 163/4885

“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.