SCHEMBL2385236

SCHEMBL2385236

N#Cc1nccc(COc2nsnc2N2CCN(C(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)n1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 5/20 0.43
P2RY12 Q9H244 8/20 0.41
NR2E1 Q9Y466 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAPK10 P53779 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 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
SCHEMBL2384368 0.88 TRPV1 (0.45) TRPV1NR2E1NPSR1HSD17B10MAPK10
SCHEMBL2383998 0.87 TRPV1 (0.43) TRPV1NR2E1NPSR1HSD17B10MAPK10
SCHEMBL5573021 0.87 TRPV1 (0.44) TRPV1NR2E1NPSR1HSD17B10MAPK10
SCHEMBL2382997 0.87 TRPV1 (0.44) TRPV1NR2E1NPSR1HSD17B10MAPK10
SCHEMBL2428528 0.87 TRPV1 (0.44) TRPV1NR2E1NPSR1HSD17B10MAPK10
SCHEMBL12250954 0.86 TRPV1 (0.43) TRPV1NR2E1NPSR1HSD17B10MAPK10
SCHEMBL2384751 0.86 TRPV1 (0.43) TRPV1NR2E1NPSR1HSD17B10MAPK10
SCHEMBL2385153 0.85 MAPK10 (0.45) TRPV1NR2E1NPSR1HSD17B10MAPK10
SCHEMBL2381547 0.85 TRPV1 (0.43) TRPV1NR2E1NPSR1HSD17B10MAPK10
SCHEMBL12250948 0.85 TRPV1 (0.43) TRPV1NR2E1NPSR1HSD17B10MAPK10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 4108/4885P2RY12 1298/4885NR2E1 2125/4885

“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.