SCHEMBL683776

SCHEMBL683776

O=C(Cc1ccccc1)N/N=C/c1cc(Br)cc(Br)c1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 1.00
KMT2A Q03164 9/20 1.00
MAPT P10636 9/20 0.78
KDM4E B2RXH2 6/20 0.78
HTT P42858 5/20 0.78
RAB9A P51151 4/20 0.78
LMNA P02545 7/20 0.68
SMN1; SMN2 Q16637 3/20 0.68
HPGD P15428 1/20 0.68
TDP1 Q9NUW8 2/20 0.59
MAPK1 P28482 1/20 0.59
L3MBTL1 Q9Y468 2/20 0.59
HSP90AA1 P07900 1/20 0.59
CYP1A2 P05177 2/20 0.58
CYP2C9 P11712 2/20 0.58
CYP2C19 P33261 2/20 0.58
CYP3A4 P08684 1/20 0.58
NPC1 O15118 3/20 0.57
POLB P06746 2/20 0.57
MCL1 Q07820 1/20 0.57

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
SCHEMBL685222 0.88 MEN1 (0.78) MEN1KMT2AMAPTKDM4EHTT
SCHEMBL12218569 0.84 KMT2A (0.78) MEN1KMT2AMAPTKDM4EHTT
SCHEMBL1669523 0.83 MEN1 (0.72) MEN1KMT2AMAPTKDM4EHTT
SCHEMBL1669525 0.83 MEN1 (0.72) MEN1KMT2AMAPTKDM4EHTT
SCHEMBL31615212 0.81 MAPT (0.77) MEN1KMT2AMAPTKDM4EHTT
SCHEMBL684597 0.81 MAPT (0.77) MEN1KMT2AMAPTKDM4EHTT
SCHEMBL28423189 0.78 BRD4 (0.65) MEN1KMT2AMAPTKDM4EHTT
SCHEMBL28423188 0.78 BRD4 (0.65) MEN1KMT2AMAPTKDM4EHTT
SCHEMBL12888178 0.78 SIRT1 (0.67) MEN1KMT2AMAPTKDM4EHTT
SCHEMBL684903 0.78 KMT2A (0.78) MEN1KMT2AMAPTKDM4EHTT

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-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 US disclosed
US-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 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-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, SOD3 MEN1 536/4885KMT2A 1362/4885MAPT 1491/4885

“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.