SCHEMBL24909796

SCHEMBL24909796

Cn1nc(-c2cc(C#N)cc(C(F)(F)F)c2O)cc1F

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.34
XDH P47989 2/20 0.34
SLC22A12 Q96S37 2/20 0.34
CYP11B2 P19099 1/20 0.34
CYP2C9 P11712 2/20 0.34
TTR P02766 1/20 0.33
ALB P02768 1/20 0.33
KIF11 P52732 1/20 0.32
CYP19A1 P11511 1/20 0.32
TRPV4 Q9HBA0 1/20 0.31
ALDH1A1 P00352 2/20 0.30
NSD2 O96028 1/20 0.30
NTRK1 P04629 1/20 0.30
GAA P10253 1/20 0.30
P4HB P07237 1/20 0.30
SSTR4 P31391 1/20 0.30

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
SCHEMBL24910103 0.87 AR (0.40) ARXDHSLC22A12CYP11B2CYP2C9
SCHEMBL24909416 0.81 CYP11B2 (0.36) ARXDHSLC22A12CYP11B2CYP2C9
SCHEMBL24909793 0.78 HDAC3 (0.39) ARXDHSLC22A12CYP11B2ALDH1A1
SCHEMBL24910072 0.75 AR (0.34) ARXDHSLC22A12CYP11B2CYP2C9
SCHEMBL24909950 0.75 AR (0.33) ARXDHSLC22A12CYP2C9KIF11
SCHEMBL24909738 0.75 CYP11B2 (0.56) ARXDHSLC22A12CYP11B2CYP2C9
SCHEMBL24909946 0.75 PDE3B (0.38) ARXDHSLC22A12CYP2C9TTR
SCHEMBL24909943 0.75 CYP11B2 (0.36) ARXDHSLC22A12CYP11B2KIF11
SCHEMBL24909927 0.74 VCP (0.39) XDHSLC22A12TRPV4ALDH1A1GAA
SCHEMBL24909915 0.73 KIF11 (0.41) ARXDHSLC22A12CYP2C9TTR

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-20230024283-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-01-26 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-20230024283-A1 HERBICIDAL COMPOUNDS DDT, CBR3, GLRX3 AR 3997/4885XDH 662/4885SLC22A12 1281/4885

“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.