SCHEMBL4262948

SCHEMBL4262948

CC(C)(C)c1cccc(NC(=O)c2cc(Cl)ccc2O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P2RX1 P51575 13/20 1.00
TMPRSS4 Q9NRS4 9/20 0.77
P2RX4 Q99571 5/20 0.77
P2RX7 Q99572 5/20 0.77
SLC2A1 P11166 1/20 0.77
MEN1 O00255 1/20 0.62
IKBKB O14920 1/20 0.62
CHUK O15111 1/20 0.62
KDR P35968 1/20 0.62
FLT3 P36888 1/20 0.62
KMT2A Q03164 1/20 0.62
MYLK Q15746 1/20 0.62
MAP4K5 Q9Y4K4 1/20 0.62
FADS1 O60427 2/20 0.58
KCNMA1 Q12791 1/20 0.57

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
SCHEMBL330263 0.88 P2RX1 (0.78) P2RX1TMPRSS4P2RX4P2RX7SLC2A1
SCHEMBL29386800 0.87 TMPRSS4 (1.00) P2RX1TMPRSS4P2RX4P2RX7SLC2A1
SCHEMBL330629 0.87 TMPRSS4 (1.00) P2RX1TMPRSS4P2RX4P2RX7SLC2A1
SCHEMBL11932152 0.84 P2RX1 (1.00) P2RX1TMPRSS4P2RX4P2RX7SLC2A1
SCHEMBL3860231 0.82 P2RX1 (0.78) P2RX1TMPRSS4P2RX4P2RX7SLC2A1
SCHEMBL14198848 0.81 P2RX1 (0.71) P2RX1TMPRSS4P2RX4P2RX7SLC2A1
SCHEMBL330581 0.81 P2RX1 (0.76) P2RX1TMPRSS4P2RX4P2RX7SLC2A1
SCHEMBL21652183 0.81 HDAC8 (0.76) P2RX1MEN1KMT2A
SCHEMBL538439 0.80 TMPRSS4 (1.00) P2RX1TMPRSS4P2RX4P2RX7SLC2A1
SCHEMBL11932156 0.80 P2RX1 (0.78) P2RX1TMPRSS4P2RX4P2RX7SLC2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8614205-B2 Glutamate receptor modulators and therapeutic agents WOOD RICHARD D (US) 2013-12-24 US disclosed
US-20130324555-A1 Method of use of pharmaceutical formulations for the treatment of apicomplexan diseases in animals WOOD RICHARD DELAREY (US) 2013-12-05 US disclosed
US-20130150416-A1 Glutamate receptor modulators and therapeutic agents WOOD RICHARD D (US) 2013-06-13 US disclosed
US-20130150416-A1 Glutamate receptor modulators and therapeutic agents WOOD RICHARD D (US) 2013-06-13 US disclosed
US-20130150416-A1 Glutamate receptor modulators and therapeutic agents WOOD RICHARD D (US) 2013-06-13 US disclosed
US-8211882-B2 Glutamate receptor modulators and therapeutic agents WOOD RICHARD DELAREY (US) 2012-07-03 US disclosed
US-8211882-B2 Glutamate receptor modulators and therapeutic agents WOOD RICHARD DELAREY (US) 2012-07-03 US disclosed
US-8211882-B2 Glutamate receptor modulators and therapeutic agents WOOD RICHARD DELAREY (US) 2012-07-03 US disclosed
WO-2010101648-A1 GLUTAMATE RECEPTOR MODULATORS AND THERAPEUTIC AGENTS WOOD RICHARD D (US) 2010-09-10 WO disclosed
US-20090239919-A1 Glutamate receptor modulators and therapeutic agents WOOD RICHARD DELAREY 2009-09-24 US disclosed
US-20090239919-A1 Glutamate receptor modulators and therapeutic agents WOOD RICHARD DELAREY 2009-09-24 US disclosed
US-20090239919-A1 Glutamate receptor modulators and therapeutic agents WOOD RICHARD DELAREY 2009-09-24 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-20090239919-A1 Glutamate receptor modulators and therapeutic agents GRM5, GRM1, GRIK5 P2RX1 542/4885TMPRSS4 2378/4885P2RX4 611/4885
US-20130150416-A1 Glutamate receptor modulators and therapeutic agents GRM5, GRM1, GRIK5 P2RX1 365/4885TMPRSS4 2318/4885P2RX4 388/4885
US-20130324555-A1 Method of use of pharmaceutical formulations for the treatment of apicomplexan diseases in animals PIGS, ASAH2, ASAH1 P2RX1 827/4885TMPRSS4 1044/4885P2RX4 1017/4885

“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.