SCHEMBL2705627

SCHEMBL2705627

Cc1cccc2nc(COc3ccc(F)c(C(N)=O)c3F)ccc12

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 10/20 0.40
CYSLTR1 Q9Y271 2/20 0.38
CYSLTR2 Q9NS75 1/20 0.38
GPBAR1 Q8TDU6 1/20 0.35
PPARG P37231 1/20 0.35
EPHB4 P54760 1/20 0.35
PKMYT1 Q99640 1/20 0.35

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
SCHEMBL2705641 0.87 BACE1 (0.36) MRGPRX4CYSLTR1CYSLTR2GPBAR1PPARG
SCHEMBL2706617 0.84 MRGPRX4 (0.41) MRGPRX4CYSLTR1CYSLTR2
SCHEMBL202543 0.83 GPBAR1 (0.48) CYSLTR1CYSLTR2GPBAR1
SCHEMBL202189 0.82 MRGPRX4 (0.42) MRGPRX4
SCHEMBL2707218 0.81 CYSLTR1 (0.39) MRGPRX4CYSLTR1CYSLTR2GPBAR1PPARG
SCHEMBL2705942 0.80 CYSLTR1 (0.40) MRGPRX4CYSLTR1CYSLTR2GPBAR1PPARG
SCHEMBL2704607 0.77 MRGPRX4 (0.45) MRGPRX4
SCHEMBL2704592 0.77 MRGPRX4 (0.41) MRGPRX4CYSLTR1CYSLTR2
SCHEMBL2706569 0.77 HPGDS (0.43) CYSLTR1CYSLTR2GPBAR1PPARG
SCHEMBL2705947 0.76 MRGPRX4 (0.41) MRGPRX4

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 14 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-20150191420-A1 ANTIBACTERIAL AGENTS TAXIS PHARMACEUTICALS, INC. 2015-07-09 US disclosed
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-8865736-B2 Antibacterial agents Biota Scientific Pty Ltd (AU) 2014-10-21 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-20130072520-A2 ANTIBACTERIAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2013-03-21 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
US-20120122918-A1 ANTIBACTERIAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2012-05-17 US disclosed
US-8088791-B2 Antibacterial agents Biots Scientific Management Pty Ltd (AU) 2012-01-03 US disclosed
US-20100173933-A1 ANTIBACTERIAL AGENTS PROLYSIS LTD (GB) 2010-07-08 US disclosed
WO-2007107758-A1 ANTIBACTERIAL AGENTS PROLYSIS LTD (GB) 2007-09-27 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 (4 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 MRGPRX4 1730/4885CYSLTR1 1752/4885CYSLTR2 2337/4885
US-20130072520-A2 ANTIBACTERIAL AGENTS ALK, ROS1, NOX1 MRGPRX4 3870/4885CYSLTR1 1257/4885CYSLTR2 1644/4885
US-20150191420-A1 ANTIBACTERIAL AGENTS ALK, ARG1, ROS1 MRGPRX4 1829/4885CYSLTR1 1641/4885CYSLTR2 2130/4885
US-20100173933-A1 ANTIBACTERIAL AGENTS ALK, ROS1, NOX1 MRGPRX4 3870/4885CYSLTR1 1257/4885CYSLTR2 1644/4885

“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.