SCHEMBL22902191

SCHEMBL22902191

O=c1c(-c2ccc([N+](=O)[O-])cc2O)c[nH]c2c(-c3ccc(Cl)c(Cl)c3)c(C3CC3)nn12

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ARF6 P62330 9/20 0.72
PSD A5PKW4 5/20 0.43
EGFR P00533 1/20 0.36
EIF4E P06730 1/20 0.35
HSD17B10 Q99714 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
PGR P06401 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
SCHEMBL20796528 0.87 ARF6 (0.69) ARF6
SCHEMBL20796520 0.85 ARF6 (0.57) ARF6
SCHEMBL20796641 0.85 ARF6 (0.70) ARF6EIF4E
SCHEMBL20796526 0.85 ARF6 (0.69) ARF6PSD
SCHEMBL22902219 0.83 ARF6 (1.00) ARF6PSD
SCHEMBL20796537 0.83 ARF6 (0.71) ARF6EIF4E
SCHEMBL20796533 0.83 ARF6 (0.72) ARF6PSDEIF4E
SCHEMBL19084647 0.75 ARF6 (0.64) ARF6PSDEGFRHSD17B10ALDH1A1
SCHEMBL22902288 0.72 ARF6 (0.71) ARF6PSD
SCHEMBL20796637 0.70 ARF6 (0.55) ARF6EIF4E

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-11414442-B2 ARF6 inhibitors and related methods NAVIGEN, INC. (US) 2022-08-16 US disclosed
US-20210017201-A1 ARF6 INHIBITORS AND RELATED METHODS NAVIGEN, INC. 2021-01-21 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-20210017201-A1 ARF6 INHIBITORS AND RELATED METHODS ARF6, ARF1, ARF5 ARF6 1/4885PSD 695/4885EGFR 1705/4885
US-11414442-B2 ARF6 inhibitors and related methods ARF6, ARF1, ARF5 ARF6 1/4885PSD 695/4885EGFR 1705/4885

“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.