SCHEMBL18360442

SCHEMBL18360442

CS(=O)(=O)c1ccc(CNC(=O)c2cc3c(cc2Cl)COB3O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.45
CA2 P00918 5/20 0.45
CA12 O43570 3/20 0.44
CA9 Q16790 3/20 0.44
CCR1 P32246 1/20 0.43
EPHX2 P34913 1/20 0.42
NR1H4 Q96RI1 1/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPK8 P45983 2/20 0.41
MAPK9 P45984 2/20 0.41
CA3 P07451 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40
CA7 P43166 1/20 0.40
CA13 Q8N1Q1 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
PRKD3 O94806 1/20 0.40

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
SCHEMBL18360476 0.88 LMNA (0.46) CA1CA2CA12CA9CCR1
SCHEMBL18360397 0.85 CA1 (0.60) CA1CA2CA12CA9CA3
SCHEMBL18360535 0.84 PDE4A (0.47) CA1CA2CA12CA9MEN1
SCHEMBL18360510 0.84 EPHX2 (0.53) CA1CA2CA12CA9EPHX2
SCHEMBL18360482 0.81 PDE4A (0.52) CA1CA2CA12CA9ALDH1A1
SCHEMBL18360484 0.80 CA1 (0.43) CA1CA2CA12CA9CA4
SCHEMBL18360445 0.80 CA1 (0.49) CA1CA2CA12CA9MEN1
SCHEMBL18360448 0.80 MEN1 (0.49) MEN1KMT2AMAPK1ALDH1A1
SCHEMBL18360472 0.78 HTT (0.51) CA1CA2CA12CA9KMT2A
SCHEMBL18360446 0.77 TNKS (0.46) CA1CA2CA12CA9MEN1

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 CA1 3964/4885CA2 1649/4885CA12 3115/4885

“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.