SCHEMBL684968

SCHEMBL684968

O=C(N/N=C/c1cc(Br)cc(Br)c1O)c1cc(I)ccc1Br

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 1/20 0.63
MAPT P10636 11/20 0.60
MEN1 O00255 11/20 0.60
KMT2A Q03164 11/20 0.60
KDM4E B2RXH2 6/20 0.60
LMNA P02545 6/20 0.60
HTT P42858 3/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
L3MBTL1 Q9Y468 3/20 0.60
NPC1 O15118 3/20 0.60
PKM P14618 1/20 0.60
SAE1 Q9UBE0 1/20 0.60
UBA2 Q9UBT2 1/20 0.60
MAPK1 P28482 3/20 0.57
RAB9A P51151 3/20 0.55
NPSR1 Q6W5P4 1/20 0.55
HPGD P15428 2/20 0.52
TDP1 Q9NUW8 3/20 0.51
POLB P06746 2/20 0.50
ALOX12 P18054 1/20 0.50

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
SCHEMBL685228 0.90 PIK3CG (0.59) PIK3CGMAPTMEN1KMT2AKDM4E
SCHEMBL684966 0.85 PIK3CG (0.63) PIK3CGMAPTMEN1KMT2AKDM4E
SCHEMBL685223 0.82 PIK3CG (0.59) PIK3CGMAPTMEN1KMT2AKDM4E
SCHEMBL683826 0.81 KDM4E (0.63) PIK3CGMAPTMEN1KMT2AKDM4E
SCHEMBL22179536 0.80 PIK3CG (0.69) PIK3CGMAPTMEN1KMT2AKDM4E
SCHEMBL1638640 0.80 PIK3CG (0.72) PIK3CGMAPTMEN1KMT2AKDM4E
SCHEMBL4447278 0.80 PIK3CG (0.72) PIK3CGMAPTMEN1KMT2AKDM4E
SCHEMBL1638643 0.80 PIK3CG (0.72) PIK3CGMAPTMEN1KMT2AKDM4E
SCHEMBL22179641 0.79 PIK3CG (0.64) PIK3CGMAPTMEN1KMT2AKDM4E
SCHEMBL20587692 0.79 PIK3CG (0.64) PIK3CGMAPTMEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461078-B2 Fungicidal compositions including hydrazone derivatives and copper DOW AGROSCIENCES LLC (US) 2013-06-11 US disclosed
US-8461078-B2 Fungicidal compositions including hydrazone derivatives and copper DOW AGROSCIENCES LLC (US) 2013-06-11 US disclosed
US-20120107416-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-05-03 US disclosed
US-20120107416-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-05-03 US disclosed
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 (2 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 PIK3CG 2876/4885MAPT 1491/4885MEN1 536/4885
US-20120107416-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 PIK3CG 2911/4885MAPT 921/4885MEN1 508/4885

“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.