SCHEMBL7077015

SCHEMBL7077015

CC(Oc1cc(C#N)cc(C#N)c1)c1cccc(Oc2cc(C#N)cc(C#N)c2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CYP2D6 P10635 1/20 0.40
ALOX5 P09917 2/20 0.38
MAPT P10636 2/20 0.37
HPGD P15428 1/20 0.37
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
AR P10275 1/20 0.36
RORC P51449 1/20 0.35
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
MITF O75030 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
GFER P55789 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL7072552 0.88 PTGS1 (0.44) PTGS1MEN1KMT2ACYP2D6ALOX5
SCHEMBL7070749 0.80 SMN1; SMN2 (0.50) MEN1KMT2AMAPTSLC6A2SLC6A4
SCHEMBL7072557 0.77 PDE4A (0.50) MEN1KMT2AMAPTSLC6A2SLC6A4
SCHEMBL7069974 0.77 PDE4A (0.50) MEN1KMT2AMAPTSLC6A2SLC6A4
SCHEMBL507026 0.77 CYP19A1 (0.47) PTGS1MEN1KMT2ACYP2D6ALOX5
SCHEMBL506308 0.77 SLC6A2 (0.53) ALOX5SLC6A2SLC6A4MGLLFFAR1
SCHEMBL19317610 0.77 PTGS1 (0.43) PTGS1MEN1KMT2ACYP2D6ALOX5
SCHEMBL7070717 0.76 MEN1 (0.50) MEN1KMT2AMAPTHPGDSLC6A2
SCHEMBL7071827 0.74 AR (0.59) MEN1KMT2AMAPTARPDE4A
SCHEMBL7073983 0.74 CYP19A1 (0.54) MEN1KMT2AMAPTARPDE4A

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 PTGS1 1999/4885MEN1 4787/4885KMT2A 1086/4885

“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.