SCHEMBL4567013

SCHEMBL4567013

Cc1ccc(-c2nc(COc3ccc(F)c(C(N)=O)c3F)sc2-c2cccnc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 16/20 0.55
KDM4E B2RXH2 2/20 0.41
GFER P55789 1/20 0.41
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL201606 0.92 PPARD (0.50) PPARD
SCHEMBL4567018 0.89 PPARD (0.46) PPARD
SCHEMBL4567015 0.86 KDM4E (0.42) PPARDKDM4EGFER
SCHEMBL4567014 0.86 PPARD (0.41) PPARD
SCHEMBL4567033 0.86 PPARD (0.54) PPARD
SCHEMBL4567019 0.84 PPARD (0.39) PPARD
SCHEMBL2705737 0.82 PPARD (0.58) PPARD
SCHEMBL4567006 0.82 PPARD (0.36) PPARD
SCHEMBL2706104 0.82 PPARD (0.56) PPARD
SCHEMBL16421089 0.81 PPARD (0.52) PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150191420-A1 ANTIBACTERIAL AGENTS TAXIS PHARMACEUTICALS, INC. 2015-07-09 US disclosed
US-8865736-B2 Antibacterial agents Biota Scientific Pty Ltd (AU) 2014-10-21 US disclosed
US-20130072520-A2 ANTIBACTERIAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2013-03-21 US disclosed
US-20120122918-A1 ANTIBACTERIAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2012-05-17 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 (3 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-20120122918-A1 ANTIBACTERIAL AGENTS ALK, ROS1, ARG1 PPARD 3683/4885KDM4E 819/4885GFER 739/4885
US-20130072520-A2 ANTIBACTERIAL AGENTS ALK, ROS1, NOX1 PPARD 3689/4885KDM4E 2407/4885GFER 137/4885
US-20150191420-A1 ANTIBACTERIAL AGENTS ALK, ARG1, ROS1 PPARD 3598/4885KDM4E 1251/4885GFER 614/4885

“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.