SCHEMBL7549604

SCHEMBL7549604

O=C(Nc1cc(Cl)ccc1Cl)Nc1ccccc1C(=O)O

nearest known ligand 0.78

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 15/20 0.78
DHODH Q02127 1/20 0.71
RAB9A P51151 3/20 0.68
KDM4E B2RXH2 2/20 0.68
NPC1 O15118 2/20 0.68
MEN1 O00255 2/20 0.68
KMT2A Q03164 2/20 0.68
ALDH1A1 P00352 1/20 0.68
MAPT P10636 1/20 0.68
NFKB1 P19838 1/20 0.68
GFER P55789 1/20 0.68
NFKB2 Q00653 1/20 0.68
RELA Q04206 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
TRPV1 Q8NER1 1/20 0.58

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
SCHEMBL6823663 0.89 CHRNA7 (0.68) GRIK1DHODHRAB9AKDM4ENPC1
SCHEMBL5595227 0.88 GRIK1 (0.74) GRIK1DHODHRAB9AKDM4ENPC1
SCHEMBL7675947 0.85 GRIK1 (0.74) GRIK1RAB9AKDM4ENPC1MEN1
SCHEMBL5950332 0.85 GRIK1 (0.78) GRIK1DHODHRAB9AKDM4ENPC1
SCHEMBL16489012 0.84 EGFR (0.66) GRIK1DHODHMEN1KMT2AMAPT
SCHEMBL7822988 0.83 MEN1 (0.63) GRIK1RAB9AKDM4ENPC1MEN1
SCHEMBL11983339 0.83 DHODH (1.00) GRIK1DHODHRAB9AKDM4ENPC1
SCHEMBL5594687 0.82 KDM4E (0.68) GRIK1DHODHRAB9AKDM4ENPC1
SCHEMBL4912702 0.82 RAB9A (0.59) GRIK1DHODHRAB9AKDM4ENPC1
SCHEMBL7554091 0.82 GRIK1 (0.67) GRIK1DHODHRAB9AKDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020128321-A1 IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION 2002-09-12 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-20020128321-A1 IL-8 receptor antagonists CXCL8, CCR8, IL1RN GRIK1 3379/4885DHODH 2703/4885RAB9A 1746/4885

“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.