SCHEMBL7072041

SCHEMBL7072041

N#Cc1cc(C#N)cc(Oc2cccc(I)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 1/20 0.41
MITF O75030 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
GFER P55789 1/20 0.41
KMT2A Q03164 1/20 0.41
NLRP1 Q9C000 1/20 0.41
NOD2 Q9HC29 1/20 0.41
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
FFAR1 O14842 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
MAP4K4 O95819 1/20 0.38
AR P10275 2/20 0.38
AKR1C3 P42330 1/20 0.37
CYP19A1 P11511 1/20 0.37

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
SCHEMBL920249 0.91 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DFFAR1
SCHEMBL7070749 0.89 SMN1; SMN2 (0.50) SMN1; SMN2MEN1MITFALDH1A1GAA
SCHEMBL9284252 0.86 CYP19A1 (0.51) SMN1; SMN2MEN1MITFALDH1A1GAA
SCHEMBL7069974 0.85 PDE4A (0.50) SMN1; SMN2MEN1MITFALDH1A1GAA
SCHEMBL7072557 0.85 PDE4A (0.50) SMN1; SMN2MEN1MITFALDH1A1GAA
SCHEMBL7070717 0.83 MEN1 (0.50) SMN1; SMN2MEN1MITFALDH1A1GAA
SCHEMBL3845360 0.82 SMN1; SMN2 (0.50) SMN1; SMN2MEN1MITFALDH1A1GAA
SCHEMBL7073983 0.81 CYP19A1 (0.54) SMN1; SMN2MEN1MITFALDH1A1GAA
SCHEMBL27839327 0.81 PDE4A (0.53) SMN1; SMN2MEN1MITFALDH1A1GAA
SCHEMBL3841098 0.80 ALDH1A1 (0.46) SMN1; SMN2MEN1MITFALDH1A1GAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030181334-A1 Herbicidal method BAYER CROPSCIENCE LIMITED (GB) 2003-09-25 US disclosed
WO-2003051119-A1 NEW HERBICIDAL COMPOUNDS AND METHOD BAYER CROPSCIENCE LIMITED (GB) 2003-06-26 WO 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-20030181334-A1 Herbicidal method DDT, HAAO, CYP4X1 SMN1; SMN2 4836/4885MEN1 4787/4885MITF 2877/4885

“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.