SCHEMBL22010492

SCHEMBL22010492

CC1(C)CNc2cc(/C=C/C(=O)O)cnc2NC1=O

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.41
P4HTM Q9NXG6 1/20 0.36
CYP26A1 O43174 1/20 0.34
ALOX5 P09917 1/20 0.33

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
Trifluoroacetic Acid SCHEMBL21963918 0.93 RAB9A (0.37) RAB9AP4HTM
SCHEMBL21964051 0.89 RAB9A (0.38) RAB9AP4HTMALOX5
SCHEMBL31033288 0.89 RAB9A (0.38) RAB9AP4HTMALOX5
SCHEMBL21963751 0.84 KDM4E (0.34)
SCHEMBL21963919 0.82 KDM4E (0.33)
SCHEMBL22010721 0.81 RAB9A (0.41) RAB9AP4HTMALOX5
SCHEMBL3611126 0.80 RAB9A (0.40) RAB9A
SCHEMBL3611131 0.80 RAB9A (0.40) RAB9A
Hydrochloric Acid SCHEMBL1253801 0.79 RAB9A (0.39) RAB9A
Hydrochloric Acid SCHEMBL1253798 0.79 RAB9A (0.39) RAB9A

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-20230035837-A1 ANTIBIOTIC COMPOUNDS, METHODS OF MANUFACTURING THE SAME, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND USES THEREOF DEBIOPHARM INTERNATIONAL S.A. (CH) 2023-02-02 US disclosed
WO-2020099341-A1 ANTIBIOTIC COMPOUNDS, METHODS OF MANUFACTURING THE SAME, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND USES THEREOF DEBIOPHARM INTERNATIONAL S.A. (CH) 2020-05-22 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-20230035837-A1 ANTIBIOTIC COMPOUNDS, METHODS OF MANUFACTURING THE SAME, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND USES THEREOF GMPS, GNE, GANC RAB9A 2224/4885P4HTM 2530/4885CYP26A1 702/4885

“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.