SCHEMBL4816547

SCHEMBL4816547

O=C(Br)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.55
FABP5 Q01469 3/20 0.54
FABP7 O15540 2/20 0.54
EPHX2 P34913 1/20 0.51
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
HTR2A P28223 1/20 0.44
CASP3 P42574 2/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL30662444 1.00 KMT2A (0.55) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL113270 0.85 KMT2A (0.59) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL30042128 0.85 KMT2A (0.59) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL29362617 0.85 KMT2A (0.59) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL44676 0.85 KMT2A (0.58) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL15981181 0.85 KMT2A (0.58) KMT2AFABP5FABP7EPHX2CA1
Ammonia Solution, Strong SCHEMBL16430851 0.84 KMT2A (0.57) KMT2AFABP5FABP7EPHX2CA1
Hydrochloric Acid SCHEMBL1234617 0.84 KMT2A (0.57) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL12016740 0.83 KMT2A (0.56) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL2782675 0.83 KMT2A (0.56) KMT2AFABP5FABP7EPHX2CA1

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-7384754-B2 Enrichment and tagging of glycosylated proteins AGILENT TECHNOLOGIES, INC. (US) 2008-06-10 US disclosed
US-7208573-B2 Enrichment of phosphate peptides for proteomic analysis AGILENT TECHNOLOGIES, INC. (US) 2007-04-24 US disclosed
US-20050095725-A1 Enrichment of phosphate peptides for proteomic analysis AGILENT TECHNOLOGIES, INC. 2005-05-05 US disclosed
US-20050095647-A1 Enrichment and tagging of glycosylated proteins AGILENT TECHNOLOGIES, INC. 2005-05-05 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-20050095725-A1 Enrichment of phosphate peptides for proteomic analysis PTMS, ACP1, CHAMP1 KMT2A 2060/4885FABP5 1511/4885FABP7 2369/4885

“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.