SCHEMBL2385649

SCHEMBL2385649

Nc1nccc(COc2cccnc2N2CCN(C(=O)Nc3cc(Cl)cc(C(F)(F)F)c3)CC2)n1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 6/20 0.47
RBP4 P02753 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TRPA1 O75762 1/20 0.43
KCNH2 Q12809 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42

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
SCHEMBL2383625 0.94 TRPV1 (0.51) TRPV1NPSR1HSD17B10CA12CA1
SCHEMBL2384982 0.92 PDGFRB (0.48) TRPV1RBP4TRPA1KCNH2TRPM8
SCHEMBL2383828 0.92 TRPV1 (0.48) TRPV1NPSR1HSD17B10CA12CA1
SCHEMBL2381414 0.90 TRPV1 (0.54) TRPV1NPSR1HSD17B10
SCHEMBL2384570 0.89 TRPV1 (0.47) TRPV1NPSR1HSD17B10CA12CA1
SCHEMBL2384448 0.89 TRPV1 (0.46) TRPV1NPSR1HSD17B10
SCHEMBL2384180 0.88 RBP4 (0.47) TRPV1RBP4NPSR1HSD17B10TRPA1
SCHEMBL2384692 0.87 PDGFRB (0.52) TRPV1RBP4NPSR1
SCHEMBL2385390 0.87 TRPV1 (0.46) TRPV1NPSR1HSD17B10
SCHEMBL2386301 0.87 TRPV1 (0.45) TRPV1RBP4TRPA1KCNH2TRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 US claimed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 US claimed
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 US disclosed
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 US disclosed
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 US disclosed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 US disclosed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 US disclosed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 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 (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-20070275952-A1 Tie-2 Modulators and Methods of Use TIE1, TEK, KDR TRPV1 4108/4885RBP4 2966/4885NPSR1 3854/4885

“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.