SCHEMBL2382791

SCHEMBL2382791

O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCN(c2nsnc2OCCN2CCCC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 4/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ GAA P10253 1/20 0.42
▸ FAAH O00519 1/20 0.42
▸ PDGFRB P09619 7/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ CNR2 P34972 1/20 0.41
▸ CSF1R P07333 1/20 0.41
▸ KIT P10721 1/20 0.41
▸ FLT3 P36888 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL12302306 0.94 TRPV1 (0.44) TRPV1RXFP1PDGFRBCSF1RKIT
SCHEMBL2385060 0.92 RXFP1 (0.46) TRPV1RXFP1PDGFRBFLT3HTT
SCHEMBL2386608 0.85 PDGFRB (0.46) TRPV1PDGFRBKIT
SCHEMBL12250961 0.85 TRPV1 (0.40) TRPV1RXFP1GAAFAAHCNR2
SCHEMBL12251015 0.84 TRPV1 (0.41) TRPV1GAAKDM4ECNR2KIT
SCHEMBL12251019 0.84 TRPV1 (0.40) TRPV1RXFP1GAAPDGFRBKIT
SCHEMBL2382905 0.83 TRPV1 (0.46) TRPV1GAAKDM4EKITLMNA
SCHEMBL2384156 0.82 TRPV1 (0.43) TRPV1KITLMNAMAPTHTT
SCHEMBL2382772 0.81 TRPV1 (0.49) TRPV1PDGFRBKIT
SCHEMBL2382619 0.81 TRPV1 (0.48) TRPV1FAAHKITLMNAMAPT

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-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-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
EP-1608373-A2 TIE-2 MODULATORS AND METHODS OF USE Exelixis Inc. (US) 2005-12-28 — — EP disclosed
WO-2004083235-A2 TIE-2 MODULATORS AND METHODS OF USE EXELIXIS INC. (US) 2004-09-30 — — 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-20070275952-A1 Tie-2 Modulators and Methods of Use TIE1, TEK, KDR TRPV1 4108/4885RXFP1 1413/4885GAA 3807/4885

“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.

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