SCHEMBL13734870

SCHEMBL13734870

COc1cccc(-c2nc(C(CO)Oc3ccc(F)c(C(N)=O)c3F)oc2Br)c1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 1/20 0.38
RIPK2 O43353 1/20 0.38
CTSA P10619 2/20 0.36
PDE4B Q07343 9/20 0.36
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
TRPV3 Q8NET8 1/20 0.33
BRAF P15056 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
PLG P00747 1/20 0.33
PLAU P00749 1/20 0.33
PARP1 P09874 1/20 0.33
DHODH Q02127 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 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
SCHEMBL19210489 0.90 RXRA (0.39) IKBKBRIPK2CTSAPDE4BRXRA
SCHEMBL13734542 0.90 RIPK2 (0.38) IKBKBRIPK2CTSAPDE4BRXRA
SCHEMBL13731829 0.90 IKBKB (0.34) IKBKBCTSA
SCHEMBL13733302 0.89 PIK3CD (0.30)
SCHEMBL13732554 0.87 GRM2 (0.36) CTSA
SCHEMBL13732935 0.87 IDO1 (0.35) CTSABRAF
SCHEMBL13732687 0.85 ROCK2 (0.33) PLAUPPARD
SCHEMBL13732683 0.85 ROCK2 (0.33) PLAUPPARD
SCHEMBL15711748 0.84 PDE10A (0.31) IKBKBCTSADHODH
SCHEMBL15711839 0.84 PDE10A (0.31) IKBKBCTSADHODH

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
EP-2699557-B1 3-(OXAZOL-2-YL-ETHOXY)- AND 3-(THIAZOL-2-YL-ETHOXY)-BENZAMIDE DERIVATIVES AS ANTI-BACTERIAL AGENTS BIOTA SCIENT MANAGEMENT (AU) 2017-08-16 EP claimed
US-9511073-B2 Aromatic amides and uses thereof TAXIS PHARMACEUTICALS, INC. (US) 2016-12-06 US claimed
US-20140135332-A1 AROMATIC AMIDES AND USES THEREOF BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2014-05-15 US claimed
EP-2699557-A1 AROMATIC AMIDES AND USES THEREOF Biota Scientific Management Pty Ltd (AU) 2014-02-26 EP claimed
WO-2012142671-A1 AROMATIC AMIDES AND USES THEREOF BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2012-10-26 WO claimed
EP-2699557-B1 3-(OXAZOL-2-YL-ETHOXY)- AND 3-(THIAZOL-2-YL-ETHOXY)-BENZAMIDE DERIVATIVES AS ANTI-BACTERIAL AGENTS BIOTA SCIENT MANAGEMENT (AU) 2017-08-16 EP 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-20140135332-A1 AROMATIC AMIDES AND USES THEREOF NAT1, ASNS, CYP2C9 IKBKB 1648/4885RIPK2 4771/4885CTSA 2840/4885

“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.