SCHEMBL4385836

SCHEMBL4385836

Cc1cc(-n2ccc3c(NC(=O)C(C)c4ccc(Cl)c(C(F)(F)F)c4)cccc3c2=O)n[nH]1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 5/20 0.46
TRPV1 Q8NER1 9/20 0.41
BRAF P15056 3/20 0.37
MAPK1 P28482 1/20 0.37
NTRK1 P04629 1/20 0.37
RAF1 P04049 1/20 0.36

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
SCHEMBL13587537 0.88 P2RX7 (0.47) P2RX7TRPV1BRAFMAPK1
SCHEMBL13587822 0.87 P2RX7 (0.36) P2RX7TRPV1
SCHEMBL1590853 0.78 P2RX7 (0.56) P2RX7TRPV1
SCHEMBL1590798 0.78 P2RX7 (0.68) P2RX7TRPV1
SCHEMBL1590681 0.78 P2RX7 (0.56) P2RX7TRPV1
SCHEMBL1590683 0.78 P2RX7 (0.56) P2RX7TRPV1
SCHEMBL12725009 0.71 P2RX7 (0.45) P2RX7TRPV1
SCHEMBL13587538 0.70 P2RX7 (0.65) P2RX7TRPV1
SCHEMBL13587826 0.69 P2RX7 (0.34) P2RX7TRPV1
SCHEMBL13587554 0.68 FFAR2 (0.41) P2RX7MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090298825-A1 Bicycloheteroaryl Compounds as P2x7 Modulators and Uses Thereof RENOVIS, INC. 2009-12-03 US disclosed
US-20090298825-A1 Bicycloheteroaryl Compounds as P2x7 Modulators and Uses Thereof RENOVIS, INC. 2009-12-03 US disclosed
US-20090298825-A1 Bicycloheteroaryl Compounds as P2x7 Modulators and Uses Thereof RENOVIS, INC. 2009-12-03 US disclosed
EP-1996585-A2 BICYCLOHETEROARYL COMPOUNDS AS P2X7 MODULATORS AND USES THEREOF Renovis, Inc. (US) 2008-12-03 EP disclosed
WO-2007109154-A2 BICYCLOHETEROARYL COMPOUNDS AS P2X7 MODULATORS AND USES THEREOF RENOVIS, INC. (US) 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 (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-20090298825-A1 Bicycloheteroaryl Compounds as P2x7 Modulators and Uses Thereof P2RX7, P2RX3, P2RX1 P2RX7 1/4885TRPV1 19/4885BRAF 2504/4885

“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.