SCHEMBL13167100

SCHEMBL13167100

[C-]#[N+]Cc1c(F)cccc1Br

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EED O75530 8/20 0.37
TAAR1 Q96RJ0 1/20 0.33
GAA P10253 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GRM2 Q14416 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL29956400 0.85 TAAR1 (0.39) TAAR1GAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL29952198 0.76 TAAR1 (0.55) TAAR1GAAKDM4ESMN1; SMN2HTT
SCHEMBL27577860 0.75 TAAR1 (0.39) EEDTAAR1GAAKDM4EALDH1A1
SCHEMBL4243083 0.74 EED (0.41) EEDTAAR1GAAKDM4EALDH1A1
SCHEMBL29386736 0.74 EED (0.41) EEDTAAR1GAAKDM4EALDH1A1
SCHEMBL7627111 0.72 TAAR1 (0.45) EEDTAAR1GAA
SCHEMBL31614296 0.72 EED (0.43) EEDTAAR1GAAKDM4EALDH1A1
SCHEMBL15352403 0.72 EED (0.40) EEDTAAR1GAAKDM4EALDH1A1
SCHEMBL20558278 0.72 EED (0.40) EEDTAAR1GAAKDM4EALDH1A1
SCHEMBL3072191 0.72 TAAR1 (0.41) EEDTAAR1GAAKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100249145-A1 Inhibitors of VEGF Receptor and HGF Receptor Signaling METHYLGENE, INC. 2010-09-30 US disclosed
US-7790729-B2 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2010-09-07 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-20100249145-A1 Inhibitors of VEGF Receptor and HGF Receptor Signaling HGF, MET, FLT1 EED 2014/4885TAAR1 2937/4885GAA 1146/4885

“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.