SCHEMBL13618700

SCHEMBL13618700

C=C(C)NC(=O)Nc1ccc(C2=NC(Cc3ccccc3F)C(=O)Nc3ccc(Cl)cc32)cc1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 5/20 0.51
CCKBR P32239 5/20 0.50
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
ALB P02768 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL12390474 0.91 CCKBR (0.50) TRPV1CCKBRMEN1LMNAALB
SCHEMBL12390481 0.90 CCKBR (0.48) TRPV1CCKBRMEN1LMNAALB
SCHEMBL13061002 0.89 CCKBR (0.55) TRPV1CCKBRMEN1LMNAALB
SCHEMBL2263593 0.89 TRPV1 (0.55) TRPV1CCKBRMEN1LMNAALB
SCHEMBL12390483 0.89 TRPV1 (0.55) TRPV1CCKBRMEN1LMNAALB
SCHEMBL11982407 0.88 TRPV1 (0.56) TRPV1CCKBRMEN1LMNAALB
SCHEMBL14064501 0.86 TRPV1 (0.53) TRPV1CCKBRMEN1LMNAALB
SCHEMBL2267811 0.82 CCKBR (0.54) TRPV1CCKBRMEN1LMNAALB
SCHEMBL14707952 0.82 TRPV1 (0.48) TRPV1CCKBR
SCHEMBL13061384 0.82 CCKBR (0.39) TRPV1CCKBR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275099-A1 Methods and compositions for treating diseases and conditions associated with mitochondrial function REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-11-05 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-20090275099-A1 Methods and compositions for treating diseases and conditions associated with mitochondrial function ATP5F1A, ATP5MF, MT-ATP6 TRPV1 3140/4885CCKBR 4482/4885MEN1 3855/4885

“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.