SCHEMBL6481376

SCHEMBL6481376

CCOC(=O)c1ccc(Br)c(OCCn2cnnn2)c1Br

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.45
TP53 P04637 4/20 0.38
TBXAS1 P24557 1/20 0.38
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
MAPT P10636 3/20 0.37
NPSR1 Q6W5P4 2/20 0.37
LMNA P02545 1/20 0.37
KDM4E B2RXH2 5/20 0.36
ALDH1A1 P00352 3/20 0.36
HSD17B10 Q99714 2/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 2/20 0.35
USP2 O75604 1/20 0.35
THRB P10828 1/20 0.35
POLB P06746 1/20 0.35
ESR2 Q92731 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TSHR P16473 1/20 0.35
GLA P06280 1/20 0.34

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
SCHEMBL6490870 0.86 TP53 (0.39) GAATP53MEN1KMT2AMAPT
SCHEMBL6489001 0.85 TP53 (0.36) GAATP53MEN1KMT2AMAPT
SCHEMBL6480894 0.81 MAPT (0.36) TP53TBXAS1MEN1KMT2AMAPT
SCHEMBL587378 0.80 GAA (0.45) GAATP53TBXAS1MEN1KMT2A
SCHEMBL6490299 0.80 TP53 (0.33) GAATP53MAPTLMNA
SCHEMBL6489572 0.78 GAA (0.41) GAATP53TBXAS1MEN1KMT2A
SCHEMBL6493708 0.78 MAPK1 (0.33) TP53KMT2AMAPTLMNAKDM4E
SCHEMBL7559624 0.78 MAPT (0.51) MEN1KMT2AMAPTNPSR1LMNA
SCHEMBL8491964 0.77 KMT2A (0.44) GAAMEN1KMT2AMAPTNPSR1
SCHEMBL8309761 0.77 KMT2A (0.43) GAAMEN1KMT2AMAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050090398-A1 Novel tetrazole derivative useful as herbicides YANAGI AKIHIKO (JP) 2005-04-28 US disclosed
EP-1476437-A1 NOVEL TETRAZOLE DERIVATIVE USEFUL AS HERBICIDES Bayer CropScience AG (DE) 2004-11-17 EP disclosed
WO-2003066607-A1 NOVEL TETRAZOLE DERIVATIVE USEFUL AS HERBICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2003-08-14 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-20050090398-A1 Novel tetrazole derivative useful as herbicides DDT, TTI1, CYP1A1 GAA 2538/4885TP53 1908/4885TBXAS1 1999/4885

“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.