SCHEMBL7074801

SCHEMBL7074801

CSc1ccnc(Oc2cc(C#N)cc(C#N)c2)n1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.37
HPGDS O60760 1/20 0.35
ALK Q9UM73 1/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
PPARG P37231 1/20 0.33
NCOA2 Q15596 1/20 0.33
NCOA1 Q15788 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
GRM5 P41594 1/20 0.32
RAB9A P51151 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL7129617 0.79 F10 (0.40) KCNH2HPGDSGRM5KDM4ELMNA
SCHEMBL9124414 0.75 MAPK8 (0.43) ALOX5APFEN1NPSR1L3MBTL1RAB9A
SCHEMBL7075065 0.75 EPAS1 (0.39) ALOX5APFEN1
SCHEMBL7130914 0.72 KMT2A (0.43) KCNH2L3MBTL1GRM5
SCHEMBL7077027 0.72 KMT2A (0.43) KCNH2L3MBTL1GRM5
SCHEMBL7074411 0.71 MEN1 (0.50) RAB9ALMNA
SCHEMBL7074202 0.69 SYK (0.44) ALOX5APFEN1RAB9A
SCHEMBL7075747 0.69 HTT (0.49) KCNH2HPGDSPPARGNPSR1L3MBTL1
SCHEMBL8457829 0.69 RAB9A (0.51) HPGDSGRM5RAB9A
SCHEMBL7070093 0.68 AR (0.41) KDM4E

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 KCNH2 1065/4885HPGDS 3531/4885ALK 1581/4885

“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.