SCHEMBL18360526

SCHEMBL18360526

O=C(Nc1cccc(F)c1)c1cc2c(cc1Cl)COB2O

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.53
CA1 P00915 10/20 0.49
CA2 P00918 10/20 0.49
CA12 O43570 7/20 0.49
CA9 Q16790 7/20 0.49
PDE3A Q14432 1/20 0.45
CA4 P22748 3/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL18360489 0.89 CA1 (0.51) CA1CA2CA12CA9PDE3A
SCHEMBL2280730 0.81 CA1 (0.65) CA1CA2CA12CA9CA4
SCHEMBL18360549 0.81 CA12 (0.65) CA1CA2CA12CA9CA4
SCHEMBL18355006 0.79 CYP1A2 (0.50) CA1CA2CA12CA9CA4
SCHEMBL18354762 0.79 CA1 (0.50) CA1CA2CA12CA9CA4
SCHEMBL18360405 0.78 CA1 (0.47) CA1CA2CA12CA9CA4
SCHEMBL12875125 0.78 CA1 (0.79) CA1CA2CA12CA9CA4
SCHEMBL2278621 0.78 CA1 (0.61) CA1CA2CA12CA9CA4
SCHEMBL18354766 0.78 CA1 (0.48) CA1CA2CA12CA9
SCHEMBL18355007 0.76 RORC (0.48) CA1CA2CA12CA9HTT

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-20170000133-A1 BENZOXABOROLE FUNGICIDES SYNGENTA PARTICIPATIONS AG (SE) 2017-01-05 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-20170000133-A1 BENZOXABOROLE FUNGICIDES CYP4X1, BROX, CYP1B1 ENPP2 2052/4885CA1 3964/4885CA2 1649/4885

“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.