SCHEMBL4016068

SCHEMBL4016068

Fc1cccc(CCC2CNCC[N]2)c1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.43
TAAR1 Q96RJ0 3/20 0.41
SLC6A3 Q01959 2/20 0.40
DRD2 P14416 1/20 0.40
SLC6A4 P31645 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
NPC1 O15118 1/20 0.39
DAO P14920 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
SCHEMBL4015441 0.82 KCNH2 (0.36) TAAR1SLC6A3SLC6A4MAOB
SCHEMBL4436017 0.82 TAAR1 (0.44) TAAR1MAOAMAOB
SCHEMBL4021112 0.78 HTR2A (0.41) SLC6A3SLC6A4DAO
SCHEMBL28037466 0.75 MAOA (0.51) MAPK1TAAR1SLC6A3MAOAMAOB
SCHEMBL27962854 0.75 MAOA (0.51) MAPK1TAAR1SLC6A3MAOAMAOB
SCHEMBL5558065 0.74 TAAR1 (0.44) MAPK1TAAR1SLC6A3SLC6A4MAOA
SCHEMBL4023123 0.74 TAAR1 (0.40) TAAR1SLC6A3SLC6A4MAOAMAOB
SCHEMBL5557203 0.74 TAAR1 (0.44) MAPK1TAAR1SLC6A3SLC6A4MAOA
SCHEMBL4023686 0.74 HTR3A (0.37) TAAR1SLC6A4
SCHEMBL4017121 0.74 HTR1D (0.37) TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8227469-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2012-07-24 US disclosed
US-20090197879-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS BALAN CHENERA 2009-08-06 US disclosed
US-7534798-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2009-05-19 US disclosed
US-20050182067-A1 Vanilloid receptor ligands and their use in treatments AMGEN, INC. 2005-08-18 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 (2 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-20090197879-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS TRPV1, TRPV2, TRPV3 MAPK1 1490/4885TAAR1 474/4885SLC6A3 1088/4885
US-20050182067-A1 Vanilloid receptor ligands and their use in treatments TRPV1, TRPV2, TRPV3 MAPK1 1490/4885TAAR1 474/4885SLC6A3 1088/4885

“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.