SCHEMBL2385265

SCHEMBL2385265

Nc1nccc(COc2nccnc2N2CCN(C(=O)Nc3cc(F)cc(C(F)(F)F)c3)CC2)n1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 8/20 0.45
S1PR2 O95136 4/20 0.43
NR2E1 Q9Y466 1/20 0.41
NPSR1 Q6W5P4 2/20 0.41
HSD17B10 Q99714 1/20 0.41
KIT P10721 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL2385038 0.95 TRPV1 (0.48) TRPV1NR2E1NPSR1HSD17B10KIT
SCHEMBL2384448 0.91 TRPV1 (0.46) TRPV1NR2E1NPSR1HSD17B10KIT
SCHEMBL2385933 0.90 TRPV1 (0.42) TRPV1S1PR2NR2E1NPSR1HSD17B10
SCHEMBL2383249 0.89 TRPV1 (0.55) TRPV1NPSR1HSD17B10KITCA2
SCHEMBL2383828 0.89 TRPV1 (0.48) TRPV1S1PR2NPSR1HSD17B10CA12
SCHEMBL2385169 0.85 TRPV1 (0.43) TRPV1NPSR1KITKDM4EMAPT
SCHEMBL2385067 0.85 MAPT (0.45) TRPV1S1PR2NR2E1NPSR1KDM4E
SCHEMBL2384368 0.85 TRPV1 (0.45) TRPV1NR2E1NPSR1HSD17B10KIT
SCHEMBL2428790 0.84 TRPV1 (0.41) TRPV1NR2E1NPSR1HSD17B10KIT
SCHEMBL2384683 0.84 PDGFRB (0.45) TRPV1NPSR1MAPT

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 7 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-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 4108/4885S1PR2 1136/4885NR2E1 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.