SCHEMBL24910071

SCHEMBL24910071

N#Cc1cc(-c2cnn(C(F)F)c2)c(O)c(C(F)(F)F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 5/20 0.40
PDE3A Q14432 5/20 0.40
IRAK4 Q9NWZ3 1/20 0.40
RET P07949 2/20 0.36
LRRK2 Q5S007 1/20 0.36
CTSS P25774 1/20 0.33
GRM2 Q14416 3/20 0.32
CYP11B2 P19099 1/20 0.32
EP300 Q09472 3/20 0.32
PIK3CD O00329 1/20 0.31
XDH P47989 1/20 0.31
SLC22A12 Q96S37 1/20 0.31
CCNT1 O60563 1/20 0.31
CCNK O75909 1/20 0.31
CCNE1 P24864 1/20 0.31
CDK2 P24941 1/20 0.31
CDK7 P50613 1/20 0.31
CDK9 P50750 1/20 0.31
CCNH P51946 1/20 0.31
MNAT1 P51948 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
SCHEMBL24909788 0.82 CYP11B2 (0.33) CYP11B2XDHSLC22A12
SCHEMBL24909904 0.80 PDE3B (0.41) PDE3BPDE3AIRAK4LRRK2CYP11B2
SCHEMBL24909790 0.76 TGFBR1 (0.35) LRRK2XDHSLC22A12CCNT1CCNK
SCHEMBL24909746 0.74 GYS1 (0.35) LRRK2CYP11B2XDHSLC22A12
SCHEMBL24909915 0.73 KIF11 (0.41) XDHSLC22A12
SCHEMBL24909935 0.73 KIF11 (0.36) CYP11B2XDHSLC22A12
SCHEMBL24909930 0.73 KIF11 (0.39) XDHSLC22A12
SCHEMBL24910014 0.72 KIF11 (0.38) XDHSLC22A12
SCHEMBL24909774 0.72 KIF11 (0.40) LRRK2XDHSLC22A12
SCHEMBL24910040 0.71 TRPV4 (0.35) XDHSLC22A12

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 PDE3B 565/4885PDE3A 618/4885IRAK4 4400/4885

“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.